data_1T7W # _entry.id 1T7W # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.286 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1T7W RCSB RCSB022422 WWPDB D_1000022422 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 1ZAG . unspecified PDB 1t7v . unspecified PDB 1t7x . unspecified PDB 1t7y . unspecified PDB 1t7z . unspecified PDB 1t80 . unspecified # _pdbx_database_status.entry_id 1T7W _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2004-05-11 _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.SG_entry . _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_mr ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Delker, S.L.' 1 'West Jr., A.P.' 2 'McDermott, L.' 3 'Kennedy, M.W.' 4 'Bjorkman, P.J.' 5 # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Crystallographic studies of ligand binding by Zn-alpha2-glycoprotein.' J.Struct.Biol. 148 205 213 2004 JSBIEM US 1047-8477 0803 ? 15477100 10.1016/j.jsb.2004.04.009 1 'Crystal structure of human ZAG, a fat-depleting factor related to MHC molecules' Science 283 1914 1919 1999 SCIEAS US 0036-8075 0038 ? ? 10.1126/science.283.5409.1914 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Delker, S.L.' 1 primary 'West Jr., A.P.' 2 primary 'McDermott, L.' 3 primary 'Kennedy, M.W.' 4 primary 'Bjorkman, P.J.' 5 1 'Sanchez, L.M.' 6 1 'Chirino, A.J.' 7 1 'Bjorkman, P.J.' 8 # _cell.entry_id 1T7W _cell.length_a 121.681 _cell.length_b 121.681 _cell.length_c 65.360 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.pdbx_unique_axis ? _cell.Z_PDB 8 # _symmetry.entry_id 1T7W _symmetry.space_group_name_H-M 'P 43 21 2' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.Int_Tables_number 96 _symmetry.cell_setting ? _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man Zinc-alpha-2-glycoprotein 32185.953 1 ? 'N89K, N92T' ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 3 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'Zn-alpha-2-glycoprotein, Zn-alpha-2-GP' # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;QENQDGRYSLTYIYTGLSKHVEDVPAFQALGSLNDLQFFRYNSKDRKSQPMGLWRQVEGMEDWKQDSQLQKAREDIFMET LKDIVEYYKDSTGSHVLQGRFGCEIENNRSSGAFWKYYYDGKDYIEFNKEIPAWVPFDPAAQITKQKWEAEPVYVQRAKA YLEEECPATLRKYLKYSKNILDRQDPPSVVVTSHQAPGEKKKLKCLAYDFYPGKIDVHWTRAGEVQEPELRGDVLHNGNG TYQSWVVVAVPPQDTAPYSCHVQHSSLAQPLVVPWEAS ; _entity_poly.pdbx_seq_one_letter_code_can ;QENQDGRYSLTYIYTGLSKHVEDVPAFQALGSLNDLQFFRYNSKDRKSQPMGLWRQVEGMEDWKQDSQLQKAREDIFMET LKDIVEYYKDSTGSHVLQGRFGCEIENNRSSGAFWKYYYDGKDYIEFNKEIPAWVPFDPAAQITKQKWEAEPVYVQRAKA YLEEECPATLRKYLKYSKNILDRQDPPSVVVTSHQAPGEKKKLKCLAYDFYPGKIDVHWTRAGEVQEPELRGDVLHNGNG TYQSWVVVAVPPQDTAPYSCHVQHSSLAQPLVVPWEAS ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLN n 1 2 GLU n 1 3 ASN n 1 4 GLN n 1 5 ASP n 1 6 GLY n 1 7 ARG n 1 8 TYR n 1 9 SER n 1 10 LEU n 1 11 THR n 1 12 TYR n 1 13 ILE n 1 14 TYR n 1 15 THR n 1 16 GLY n 1 17 LEU n 1 18 SER n 1 19 LYS n 1 20 HIS n 1 21 VAL n 1 22 GLU n 1 23 ASP n 1 24 VAL n 1 25 PRO n 1 26 ALA n 1 27 PHE n 1 28 GLN n 1 29 ALA n 1 30 LEU n 1 31 GLY n 1 32 SER n 1 33 LEU n 1 34 ASN n 1 35 ASP n 1 36 LEU n 1 37 GLN n 1 38 PHE n 1 39 PHE n 1 40 ARG n 1 41 TYR n 1 42 ASN n 1 43 SER n 1 44 LYS n 1 45 ASP n 1 46 ARG n 1 47 LYS n 1 48 SER n 1 49 GLN n 1 50 PRO n 1 51 MET n 1 52 GLY n 1 53 LEU n 1 54 TRP n 1 55 ARG n 1 56 GLN n 1 57 VAL n 1 58 GLU n 1 59 GLY n 1 60 MET n 1 61 GLU n 1 62 ASP n 1 63 TRP n 1 64 LYS n 1 65 GLN n 1 66 ASP n 1 67 SER n 1 68 GLN n 1 69 LEU n 1 70 GLN n 1 71 LYS n 1 72 ALA n 1 73 ARG n 1 74 GLU n 1 75 ASP n 1 76 ILE n 1 77 PHE n 1 78 MET n 1 79 GLU n 1 80 THR n 1 81 LEU n 1 82 LYS n 1 83 ASP n 1 84 ILE n 1 85 VAL n 1 86 GLU n 1 87 TYR n 1 88 TYR n 1 89 LYS n 1 90 ASP n 1 91 SER n 1 92 THR n 1 93 GLY n 1 94 SER n 1 95 HIS n 1 96 VAL n 1 97 LEU n 1 98 GLN n 1 99 GLY n 1 100 ARG n 1 101 PHE n 1 102 GLY n 1 103 CYS n 1 104 GLU n 1 105 ILE n 1 106 GLU n 1 107 ASN n 1 108 ASN n 1 109 ARG n 1 110 SER n 1 111 SER n 1 112 GLY n 1 113 ALA n 1 114 PHE n 1 115 TRP n 1 116 LYS n 1 117 TYR n 1 118 TYR n 1 119 TYR n 1 120 ASP n 1 121 GLY n 1 122 LYS n 1 123 ASP n 1 124 TYR n 1 125 ILE n 1 126 GLU n 1 127 PHE n 1 128 ASN n 1 129 LYS n 1 130 GLU n 1 131 ILE n 1 132 PRO n 1 133 ALA n 1 134 TRP n 1 135 VAL n 1 136 PRO n 1 137 PHE n 1 138 ASP n 1 139 PRO n 1 140 ALA n 1 141 ALA n 1 142 GLN n 1 143 ILE n 1 144 THR n 1 145 LYS n 1 146 GLN n 1 147 LYS n 1 148 TRP n 1 149 GLU n 1 150 ALA n 1 151 GLU n 1 152 PRO n 1 153 VAL n 1 154 TYR n 1 155 VAL n 1 156 GLN n 1 157 ARG n 1 158 ALA n 1 159 LYS n 1 160 ALA n 1 161 TYR n 1 162 LEU n 1 163 GLU n 1 164 GLU n 1 165 GLU n 1 166 CYS n 1 167 PRO n 1 168 ALA n 1 169 THR n 1 170 LEU n 1 171 ARG n 1 172 LYS n 1 173 TYR n 1 174 LEU n 1 175 LYS n 1 176 TYR n 1 177 SER n 1 178 LYS n 1 179 ASN n 1 180 ILE n 1 181 LEU n 1 182 ASP n 1 183 ARG n 1 184 GLN n 1 185 ASP n 1 186 PRO n 1 187 PRO n 1 188 SER n 1 189 VAL n 1 190 VAL n 1 191 VAL n 1 192 THR n 1 193 SER n 1 194 HIS n 1 195 GLN n 1 196 ALA n 1 197 PRO n 1 198 GLY n 1 199 GLU n 1 200 LYS n 1 201 LYS n 1 202 LYS n 1 203 LEU n 1 204 LYS n 1 205 CYS n 1 206 LEU n 1 207 ALA n 1 208 TYR n 1 209 ASP n 1 210 PHE n 1 211 TYR n 1 212 PRO n 1 213 GLY n 1 214 LYS n 1 215 ILE n 1 216 ASP n 1 217 VAL n 1 218 HIS n 1 219 TRP n 1 220 THR n 1 221 ARG n 1 222 ALA n 1 223 GLY n 1 224 GLU n 1 225 VAL n 1 226 GLN n 1 227 GLU n 1 228 PRO n 1 229 GLU n 1 230 LEU n 1 231 ARG n 1 232 GLY n 1 233 ASP n 1 234 VAL n 1 235 LEU n 1 236 HIS n 1 237 ASN n 1 238 GLY n 1 239 ASN n 1 240 GLY n 1 241 THR n 1 242 TYR n 1 243 GLN n 1 244 SER n 1 245 TRP n 1 246 VAL n 1 247 VAL n 1 248 VAL n 1 249 ALA n 1 250 VAL n 1 251 PRO n 1 252 PRO n 1 253 GLN n 1 254 ASP n 1 255 THR n 1 256 ALA n 1 257 PRO n 1 258 TYR n 1 259 SER n 1 260 CYS n 1 261 HIS n 1 262 VAL n 1 263 GLN n 1 264 HIS n 1 265 SER n 1 266 SER n 1 267 LEU n 1 268 ALA n 1 269 GLN n 1 270 PRO n 1 271 LEU n 1 272 VAL n 1 273 VAL n 1 274 PRO n 1 275 TRP n 1 276 GLU n 1 277 ALA n 1 278 SER n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name human _entity_src_gen.gene_src_genus Homo _entity_src_gen.pdbx_gene_src_gene 'AZGP1, ZAG, ZNGP1' _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name 'Chinese hamster' _entity_src_gen.pdbx_host_org_scientific_name 'Cricetulus griseus' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 10029 _entity_src_gen.host_org_genus Cricetulus _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type Plasmid _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pBJ5-GS _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code ZA2G_HUMAN _struct_ref.pdbx_db_accession P25311 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;QENQDGRYSLTYIYTGLSKHVEDVPAFQALGSLNDLQFFRYNSKDRKSQPMGLWRQVEGMEDWKQDSQLQKAREDIFMET LKDIVEYYNDSNGSHVLQGRFGCEIENNRSSGAFWKYYYDGKDYIEFNKEIPAWVPFDPAAQITKQKWEAEPVYVQRAKA YLEEECPATLRKYLKYSKNILDRQDPPSVVVTSHQAPGEKKKLKCLAYDFYPGKIDVHWTRAGEVQEPELRGDVLHNGNG TYQSWVVVAVPPQDTAPYSCHVQHSSLAQPLVVPWEAS ; _struct_ref.pdbx_align_begin 18 _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 1T7W _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 278 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession P25311 _struct_ref_seq.db_align_beg 18 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 295 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 278 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 1T7W LYS A 89 ? UNP P25311 ASN 106 ENGINEERED 89 1 1 1T7W THR A 92 ? UNP P25311 ASN 109 ENGINEERED 92 2 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 1T7W _exptl.crystals_number 1 _exptl.method 'X-RAY DIFFRACTION' # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_percent_sol 67.27 _exptl_crystal.density_Matthews 3.76 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method MICROBATCH _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.temp 298.0 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pdbx_details 'Ammonium sulfate, PEG 400, HEPES, pH 7.5, Microbatch, temperature 298.0K' _exptl_crystal_grow.pdbx_pH_range . # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC QUANTUM 210' _diffrn_detector.pdbx_collection_date 2002-12-19 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.monochromator 'Double crystal Si(111)' _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.100 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ALS BEAMLINE 8.2.1' _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.100 _diffrn_source.pdbx_synchrotron_site ALS _diffrn_source.pdbx_synchrotron_beamline 8.2.1 # _reflns.percent_possible_obs 98.500 _reflns.entry_id 1T7W _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.d_resolution_high 2.7 _reflns.d_resolution_low 30.0 _reflns.number_all ? _reflns.number_obs 13782 _reflns.pdbx_Rmerge_I_obs 0.1 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 12.1 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.2 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.7 _reflns_shell.d_res_low 2.8 _reflns_shell.percent_possible_obs 96.900 _reflns_shell.Rmerge_I_obs 0.456 _reflns_shell.percent_possible_all 95.6 _reflns_shell.meanI_over_sigI_obs 1.8 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_redundancy ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 1T7W _refine.ls_number_reflns_all 13922 _refine.ls_number_reflns_obs 13733 _refine.ls_percent_reflns_obs 98.6 _refine.ls_d_res_high 2.70 _refine.ls_d_res_low 20.0 _refine.B_iso_min 1.51 _refine.B_iso_max 178.93 _refine.B_iso_mean 51.21 _refine.occupancy_min 1.00 _refine.occupancy_max 1.00 _refine.aniso_B[1][1] 2.44 _refine.aniso_B[2][2] 2.44 _refine.aniso_B[3][3] -4.88 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_param_bsol 30.8686 _refine.solvent_model_param_ksol 0.351417 _refine.solvent_model_details 'CNS bulk solvent model used' _refine.ls_R_factor_R_work 0.232 _refine.ls_R_factor_R_free 0.29 _refine.ls_R_factor_R_free_error 0.011 _refine.ls_number_reflns_R_free 695 _refine.ls_percent_reflns_R_free 5.1 _refine.details ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_ls_sigma_I ? _refine.ls_R_factor_all ? _refine.ls_R_factor_obs ? _refine.ls_redundancy_reflns_obs ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.ls_R_factor_R_free_error_details ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 'PDB Entry 1T7V' _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.pdbx_isotropic_thermal_model ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_SU_B ? _refine.overall_SU_ML ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_analyze.entry_id 1T7W _refine_analyze.Luzzati_d_res_low_obs 5.00 _refine_analyze.Luzzati_coordinate_error_obs 0.35 _refine_analyze.Luzzati_sigma_a_obs 0.41 _refine_analyze.Luzzati_coordinate_error_free 0.48 _refine_analyze.Luzzati_sigma_a_free 0.44 _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 2232 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 42 _refine_hist.number_atoms_solvent 0 _refine_hist.number_atoms_total 2274 _refine_hist.d_res_high 2.70 _refine_hist.d_res_low 20.0 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.weight _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function x_bond_d 0.007 . ? ? 'X-RAY DIFFRACTION' ? x_angle_deg 1.3 . ? ? 'X-RAY DIFFRACTION' ? x_torsion_deg 24.5 . ? ? 'X-RAY DIFFRACTION' ? x_torsion_impr_deg 0.78 . ? ? 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.number_reflns_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_work _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.number_reflns_R_free _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.pdbx_refine_id _refine_ls_shell.R_factor_all 2.70 2.80 1351 1286 1221 95.2 0.365 0.395 0.049 65 5.1 . . 'X-RAY DIFFRACTION' . 2.80 2.91 1364 1337 1283 98.0 0.323 0.44 0.060 54 4.0 . . 'X-RAY DIFFRACTION' . 2.91 3.04 1381 1362 1290 98.6 0.268 0.276 0.033 72 5.3 . . 'X-RAY DIFFRACTION' . 3.04 3.20 1376 1368 1305 99.4 0.273 0.336 0.042 63 4.6 . . 'X-RAY DIFFRACTION' . 3.20 3.40 1370 1368 1302 99.9 0.248 0.336 0.041 66 4.8 . . 'X-RAY DIFFRACTION' . 3.40 3.66 1384 1367 1292 98.7 0.251 0.322 0.037 75 5.5 . . 'X-RAY DIFFRACTION' . 3.66 4.03 1379 1367 1287 99.1 0.221 0.259 0.029 80 5.9 . . 'X-RAY DIFFRACTION' . 4.03 4.60 1415 1405 1333 99.2 0.181 0.245 0.029 72 5.1 . . 'X-RAY DIFFRACTION' . 4.60 5.78 1422 1406 1338 98.8 0.18 0.239 0.029 68 4.8 . . 'X-RAY DIFFRACTION' . 5.78 19.88 1500 1467 1387 97.8 0.228 0.285 0.032 80 5.5 . . 'X-RAY DIFFRACTION' . # _struct.entry_id 1T7W _struct.title 'Zn-alpha-2-glycoprotein; CHO-ZAG PEG 400' _struct.pdbx_descriptor Zinc-alpha-2-glycoprotein _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1T7W _struct_keywords.pdbx_keywords 'LIPID BINDING PROTEIN' _struct_keywords.text 'MHC class I homolog, LIPID BINDING PROTEIN' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 2 ? D N N 2 ? # _struct_biol.id 1 _struct_biol.pdbx_parent_biol_id ? _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLY A 52 ? VAL A 57 ? GLY A 52 VAL A 57 5 ? 6 HELX_P HELX_P2 2 ASP A 62 ? LYS A 89 ? ASP A 62 LYS A 89 1 ? 28 HELX_P HELX_P3 3 ASP A 138 ? GLU A 149 ? ASP A 138 GLU A 149 1 ? 12 HELX_P HELX_P4 4 PRO A 152 ? GLU A 164 ? PRO A 152 GLU A 164 1 ? 13 HELX_P HELX_P5 5 GLU A 164 ? ASP A 182 ? GLU A 164 ASP A 182 1 ? 19 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 205 SG ? ? ? 1_555 A CYS 260 SG ? ? A CYS 205 A CYS 260 1_555 ? ? ? ? ? ? ? 2.026 ? covale1 covale ? ? A ASN 108 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 108 A NAG 310 1_555 ? ? ? ? ? ? ? 1.453 ? covale2 covale ? ? A ASN 239 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 239 A NAG 320 1_555 ? ? ? ? ? ? ? 1.452 ? covale3 covale ? ? C NAG . O4 ? ? ? 1_555 D NAG . C1 ? ? A NAG 320 A NAG 321 1_555 ? ? ? ? ? ? ? 1.384 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 ILE 131 A . ? ILE 131 A PRO 132 A ? PRO 132 A 1 -0.16 2 TYR 211 A . ? TYR 211 A PRO 212 A ? PRO 212 A 1 0.10 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 8 ? B ? 4 ? C ? 3 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? anti-parallel A 6 7 ? anti-parallel A 7 8 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 GLN A 49 ? PRO A 50 ? GLN A 49 PRO A 50 A 2 LEU A 36 ? ASN A 42 ? LEU A 36 ASN A 42 A 3 PHE A 27 ? LEU A 33 ? PHE A 27 LEU A 33 A 4 ARG A 7 ? LEU A 17 ? ARG A 7 LEU A 17 A 5 VAL A 96 ? GLU A 106 ? VAL A 96 GLU A 106 A 6 ARG A 109 ? TYR A 119 ? ARG A 109 TYR A 119 A 7 LYS A 122 ? ASN A 128 ? LYS A 122 ASN A 128 A 8 ALA A 133 ? PRO A 136 ? ALA A 133 PRO A 136 B 1 SER A 188 ? GLN A 195 ? SER A 188 GLN A 195 B 2 LYS A 201 ? PHE A 210 ? LYS A 201 PHE A 210 B 3 THR A 241 ? VAL A 250 ? THR A 241 VAL A 250 B 4 LEU A 230 ? HIS A 236 ? LEU A 230 HIS A 236 C 1 ILE A 215 ? ARG A 221 ? ILE A 215 ARG A 221 C 2 TYR A 258 ? HIS A 264 ? TYR A 258 HIS A 264 C 3 LEU A 271 ? PRO A 274 ? LEU A 271 PRO A 274 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 O GLN A 49 ? O GLN A 49 N ARG A 40 ? N ARG A 40 A 2 3 O TYR A 41 ? O TYR A 41 N ALA A 29 ? N ALA A 29 A 3 4 O SER A 32 ? O SER A 32 N THR A 11 ? N THR A 11 A 4 5 N LEU A 10 ? N LEU A 10 O CYS A 103 ? O CYS A 103 A 5 6 N GLU A 104 ? N GLU A 104 O SER A 111 ? O SER A 111 A 6 7 N TYR A 117 ? N TYR A 117 O ILE A 125 ? O ILE A 125 A 7 8 N ASN A 128 ? N ASN A 128 O ALA A 133 ? O ALA A 133 B 1 2 N THR A 192 ? N THR A 192 O LYS A 204 ? O LYS A 204 B 2 3 N LYS A 201 ? N LYS A 201 O VAL A 250 ? O VAL A 250 B 3 4 O THR A 241 ? O THR A 241 N HIS A 236 ? N HIS A 236 C 1 2 N ASP A 216 ? N ASP A 216 O GLN A 263 ? O GLN A 263 C 2 3 N CYS A 260 ? N CYS A 260 O VAL A 273 ? O VAL A 273 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 310' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 320' AC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 321' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 2 ASN A 108 ? ASN A 108 . ? 1_555 ? 2 AC1 2 ARG A 171 ? ARG A 171 . ? 1_555 ? 3 AC2 4 ASP A 209 ? ASP A 209 . ? 1_555 ? 4 AC2 4 HIS A 236 ? HIS A 236 . ? 1_555 ? 5 AC2 4 ASN A 239 ? ASN A 239 . ? 1_555 ? 6 AC2 4 NAG D . ? NAG A 321 . ? 1_555 ? 7 AC3 3 HIS A 236 ? HIS A 236 . ? 1_555 ? 8 AC3 3 GLN A 243 ? GLN A 243 . ? 1_555 ? 9 AC3 3 NAG C . ? NAG A 320 . ? 1_555 ? # _atom_sites.entry_id 1T7W _atom_sites.fract_transf_matrix[1][1] 0.008218 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.008218 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.015300 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . ASP A 1 5 ? 18.646 77.359 1.115 1.00 95.04 ? 5 ASP A N 1 ATOM 2 C CA . ASP A 1 5 ? 18.292 77.772 2.504 1.00 93.22 ? 5 ASP A CA 1 ATOM 3 C C . ASP A 1 5 ? 18.285 76.565 3.431 1.00 91.65 ? 5 ASP A C 1 ATOM 4 O O . ASP A 1 5 ? 18.379 75.424 2.974 1.00 97.48 ? 5 ASP A O 1 ATOM 5 C CB . ASP A 1 5 ? 16.915 78.436 2.521 1.00 124.26 ? 5 ASP A CB 1 ATOM 6 C CG . ASP A 1 5 ? 16.892 79.750 1.767 1.00 130.93 ? 5 ASP A CG 1 ATOM 7 O OD1 . ASP A 1 5 ? 17.518 80.721 2.244 1.00 130.78 ? 5 ASP A OD1 1 ATOM 8 O OD2 . ASP A 1 5 ? 16.250 79.810 0.695 1.00 128.70 ? 5 ASP A OD2 1 ATOM 9 N N . GLY A 1 6 ? 18.168 76.822 4.732 1.00 72.94 ? 6 GLY A N 1 ATOM 10 C CA . GLY A 1 6 ? 18.152 75.742 5.703 1.00 59.34 ? 6 GLY A CA 1 ATOM 11 C C . GLY A 1 6 ? 16.878 75.663 6.530 1.00 50.96 ? 6 GLY A C 1 ATOM 12 O O . GLY A 1 6 ? 15.855 76.268 6.181 1.00 43.83 ? 6 GLY A O 1 ATOM 13 N N . ARG A 1 7 ? 16.959 74.915 7.632 1.00 46.31 ? 7 ARG A N 1 ATOM 14 C CA . ARG A 1 7 ? 15.845 74.700 8.554 1.00 43.54 ? 7 ARG A CA 1 ATOM 15 C C . ARG A 1 7 ? 15.722 75.799 9.599 1.00 38.40 ? 7 ARG A C 1 ATOM 16 O O . ARG A 1 7 ? 16.701 76.180 10.233 1.00 36.45 ? 7 ARG A O 1 ATOM 17 C CB . ARG A 1 7 ? 16.021 73.372 9.290 1.00 74.67 ? 7 ARG A CB 1 ATOM 18 C CG . ARG A 1 7 ? 16.009 72.147 8.409 1.00 87.12 ? 7 ARG A CG 1 ATOM 19 C CD . ARG A 1 7 ? 14.716 71.380 8.591 1.00 107.05 ? 7 ARG A CD 1 ATOM 20 N NE . ARG A 1 7 ? 14.563 70.879 9.954 1.00 114.74 ? 7 ARG A NE 1 ATOM 21 C CZ . ARG A 1 7 ? 13.526 70.159 10.371 1.00 120.52 ? 7 ARG A CZ 1 ATOM 22 N NH1 . ARG A 1 7 ? 12.544 69.855 9.529 1.00 115.80 ? 7 ARG A NH1 1 ATOM 23 N NH2 . ARG A 1 7 ? 13.468 69.738 11.627 1.00 119.57 ? 7 ARG A NH2 1 ATOM 24 N N . TYR A 1 8 ? 14.508 76.295 9.790 1.00 34.18 ? 8 TYR A N 1 ATOM 25 C CA . TYR A 1 8 ? 14.259 77.330 10.783 1.00 34.18 ? 8 TYR A CA 1 ATOM 26 C C . TYR A 1 8 ? 12.947 77.011 11.470 1.00 34.18 ? 8 TYR A C 1 ATOM 27 O O . TYR A 1 8 ? 11.991 76.572 10.828 1.00 34.18 ? 8 TYR A O 1 ATOM 28 C CB . TYR A 1 8 ? 14.192 78.702 10.117 1.00 51.80 ? 8 TYR A CB 1 ATOM 29 C CG . TYR A 1 8 ? 15.503 79.104 9.491 1.00 57.13 ? 8 TYR A CG 1 ATOM 30 C CD1 . TYR A 1 8 ? 16.515 79.691 10.253 1.00 52.84 ? 8 TYR A CD1 1 ATOM 31 C CD2 . TYR A 1 8 ? 15.751 78.861 8.137 1.00 51.80 ? 8 TYR A CD2 1 ATOM 32 C CE1 . TYR A 1 8 ? 17.742 80.026 9.679 1.00 52.44 ? 8 TYR A CE1 1 ATOM 33 C CE2 . TYR A 1 8 ? 16.971 79.189 7.555 1.00 59.54 ? 8 TYR A CE2 1 ATOM 34 C CZ . TYR A 1 8 ? 17.960 79.771 8.327 1.00 57.50 ? 8 TYR A CZ 1 ATOM 35 O OH . TYR A 1 8 ? 19.157 80.102 7.737 1.00 54.34 ? 8 TYR A OH 1 ATOM 36 N N . SER A 1 9 ? 12.901 77.217 12.780 1.00 27.60 ? 9 SER A N 1 ATOM 37 C CA . SER A 1 9 ? 11.686 76.938 13.522 1.00 27.60 ? 9 SER A CA 1 ATOM 38 C C . SER A 1 9 ? 11.303 78.077 14.456 1.00 27.60 ? 9 SER A C 1 ATOM 39 O O . SER A 1 9 ? 12.159 78.750 15.028 1.00 27.60 ? 9 SER A O 1 ATOM 40 C CB . SER A 1 9 ? 11.854 75.649 14.321 1.00 32.01 ? 9 SER A CB 1 ATOM 41 O OG . SER A 1 9 ? 12.779 75.827 15.372 1.00 40.03 ? 9 SER A OG 1 ATOM 42 N N . LEU A 1 10 ? 10.003 78.308 14.583 1.00 24.67 ? 10 LEU A N 1 ATOM 43 C CA . LEU A 1 10 ? 9.502 79.335 15.478 1.00 24.67 ? 10 LEU A CA 1 ATOM 44 C C . LEU A 1 10 ? 8.625 78.588 16.458 1.00 24.67 ? 10 LEU A C 1 ATOM 45 O O . LEU A 1 10 ? 7.590 78.049 16.074 1.00 24.67 ? 10 LEU A O 1 ATOM 46 C CB . LEU A 1 10 ? 8.675 80.374 14.722 1.00 30.81 ? 10 LEU A CB 1 ATOM 47 C CG . LEU A 1 10 ? 7.890 81.363 15.597 1.00 30.81 ? 10 LEU A CG 1 ATOM 48 C CD1 . LEU A 1 10 ? 8.829 82.027 16.582 1.00 30.81 ? 10 LEU A CD1 1 ATOM 49 C CD2 . LEU A 1 10 ? 7.201 82.414 14.720 1.00 30.81 ? 10 LEU A CD2 1 ATOM 50 N N . THR A 1 11 ? 9.054 78.529 17.717 1.00 36.10 ? 11 THR A N 1 ATOM 51 C CA . THR A 1 11 ? 8.285 77.825 18.740 1.00 36.10 ? 11 THR A CA 1 ATOM 52 C C . THR A 1 11 ? 7.928 78.705 19.917 1.00 36.10 ? 11 THR A C 1 ATOM 53 O O . THR A 1 11 ? 8.697 79.584 20.313 1.00 36.10 ? 11 THR A O 1 ATOM 54 C CB . THR A 1 11 ? 9.056 76.617 19.287 1.00 36.13 ? 11 THR A CB 1 ATOM 55 O OG1 . THR A 1 11 ? 9.407 75.742 18.206 1.00 36.13 ? 11 THR A OG1 1 ATOM 56 C CG2 . THR A 1 11 ? 8.206 75.856 20.283 1.00 36.13 ? 11 THR A CG2 1 ATOM 57 N N . TYR A 1 12 ? 6.750 78.463 20.472 1.00 34.92 ? 12 TYR A N 1 ATOM 58 C CA . TYR A 1 12 ? 6.273 79.194 21.635 1.00 34.92 ? 12 TYR A CA 1 ATOM 59 C C . TYR A 1 12 ? 5.828 78.182 22.674 1.00 34.92 ? 12 TYR A C 1 ATOM 60 O O . TYR A 1 12 ? 5.318 77.124 22.337 1.00 34.92 ? 12 TYR A O 1 ATOM 61 C CB . TYR A 1 12 ? 5.079 80.068 21.286 1.00 27.60 ? 12 TYR A CB 1 ATOM 62 C CG . TYR A 1 12 ? 5.343 81.126 20.250 1.00 27.60 ? 12 TYR A CG 1 ATOM 63 C CD1 . TYR A 1 12 ? 5.135 80.867 18.892 1.00 27.60 ? 12 TYR A CD1 1 ATOM 64 C CD2 . TYR A 1 12 ? 5.729 82.412 20.627 1.00 27.60 ? 12 TYR A CD2 1 ATOM 65 C CE1 . TYR A 1 12 ? 5.292 81.873 17.927 1.00 27.60 ? 12 TYR A CE1 1 ATOM 66 C CE2 . TYR A 1 12 ? 5.891 83.422 19.682 1.00 27.60 ? 12 TYR A CE2 1 ATOM 67 C CZ . TYR A 1 12 ? 5.666 83.148 18.329 1.00 27.60 ? 12 TYR A CZ 1 ATOM 68 O OH . TYR A 1 12 ? 5.797 84.150 17.396 1.00 27.60 ? 12 TYR A OH 1 ATOM 69 N N . ILE A 1 13 ? 6.021 78.507 23.940 1.00 33.53 ? 13 ILE A N 1 ATOM 70 C CA . ILE A 1 13 ? 5.608 77.620 25.012 1.00 33.53 ? 13 ILE A CA 1 ATOM 71 C C . ILE A 1 13 ? 4.945 78.473 26.077 1.00 33.53 ? 13 ILE A C 1 ATOM 72 O O . ILE A 1 13 ? 5.532 79.434 26.570 1.00 33.53 ? 13 ILE A O 1 ATOM 73 C CB . ILE A 1 13 ? 6.823 76.844 25.608 1.00 25.06 ? 13 ILE A CB 1 ATOM 74 C CG1 . ILE A 1 13 ? 7.401 75.902 24.539 1.00 25.06 ? 13 ILE A CG1 1 ATOM 75 C CG2 . ILE A 1 13 ? 6.391 76.017 26.826 1.00 25.06 ? 13 ILE A CG2 1 ATOM 76 C CD1 . ILE A 1 13 ? 8.598 75.137 24.996 1.00 26.85 ? 13 ILE A CD1 1 ATOM 77 N N . TYR A 1 14 ? 3.704 78.123 26.396 1.00 25.79 ? 14 TYR A N 1 ATOM 78 C CA . TYR A 1 14 ? 2.904 78.812 27.403 1.00 25.79 ? 14 TYR A CA 1 ATOM 79 C C . TYR A 1 14 ? 2.742 77.890 28.603 1.00 25.79 ? 14 TYR A C 1 ATOM 80 O O . TYR A 1 14 ? 2.528 76.685 28.448 1.00 25.79 ? 14 TYR A O 1 ATOM 81 C CB . TYR A 1 14 ? 1.513 79.143 26.854 1.00 39.08 ? 14 TYR A CB 1 ATOM 82 C CG . TYR A 1 14 ? 1.449 80.312 25.900 1.00 39.08 ? 14 TYR A CG 1 ATOM 83 C CD1 . TYR A 1 14 ? 2.603 80.945 25.449 1.00 39.08 ? 14 TYR A CD1 1 ATOM 84 C CD2 . TYR A 1 14 ? 0.221 80.788 25.444 1.00 39.08 ? 14 TYR A CD2 1 ATOM 85 C CE1 . TYR A 1 14 ? 2.537 82.029 24.568 1.00 39.08 ? 14 TYR A CE1 1 ATOM 86 C CE2 . TYR A 1 14 ? 0.141 81.871 24.560 1.00 39.08 ? 14 TYR A CE2 1 ATOM 87 C CZ . TYR A 1 14 ? 1.303 82.489 24.128 1.00 39.08 ? 14 TYR A CZ 1 ATOM 88 O OH . TYR A 1 14 ? 1.230 83.580 23.282 1.00 39.08 ? 14 TYR A OH 1 ATOM 89 N N . THR A 1 15 ? 2.840 78.464 29.798 1.00 31.69 ? 15 THR A N 1 ATOM 90 C CA . THR A 1 15 ? 2.702 77.698 31.024 1.00 31.69 ? 15 THR A CA 1 ATOM 91 C C . THR A 1 15 ? 1.764 78.406 31.981 1.00 31.69 ? 15 THR A C 1 ATOM 92 O O . THR A 1 15 ? 1.910 79.598 32.234 1.00 31.69 ? 15 THR A O 1 ATOM 93 C CB . THR A 1 15 ? 4.046 77.526 31.711 1.00 46.86 ? 15 THR A CB 1 ATOM 94 O OG1 . THR A 1 15 ? 4.977 76.955 30.787 1.00 46.86 ? 15 THR A OG1 1 ATOM 95 C CG2 . THR A 1 15 ? 3.910 76.603 32.898 1.00 46.86 ? 15 THR A CG2 1 ATOM 96 N N . GLY A 1 16 ? 0.792 77.674 32.506 1.00 22.97 ? 16 GLY A N 1 ATOM 97 C CA . GLY A 1 16 ? -0.138 78.272 33.435 1.00 22.97 ? 16 GLY A CA 1 ATOM 98 C C . GLY A 1 16 ? -0.371 77.363 34.626 1.00 22.97 ? 16 GLY A C 1 ATOM 99 O O . GLY A 1 16 ? -0.594 76.159 34.454 1.00 22.97 ? 16 GLY A O 1 ATOM 100 N N . LEU A 1 17 ? -0.311 77.939 35.828 1.00 36.30 ? 17 LEU A N 1 ATOM 101 C CA . LEU A 1 17 ? -0.527 77.212 37.082 1.00 36.30 ? 17 LEU A CA 1 ATOM 102 C C . LEU A 1 17 ? -1.829 77.724 37.687 1.00 36.30 ? 17 LEU A C 1 ATOM 103 O O . LEU A 1 17 ? -2.026 78.936 37.776 1.00 36.30 ? 17 LEU A O 1 ATOM 104 C CB . LEU A 1 17 ? 0.622 77.495 38.043 1.00 29.82 ? 17 LEU A CB 1 ATOM 105 C CG . LEU A 1 17 ? 2.017 77.232 37.470 1.00 29.82 ? 17 LEU A CG 1 ATOM 106 C CD1 . LEU A 1 17 ? 3.032 77.952 38.331 1.00 29.82 ? 17 LEU A CD1 1 ATOM 107 C CD2 . LEU A 1 17 ? 2.305 75.732 37.411 1.00 29.82 ? 17 LEU A CD2 1 ATOM 108 N N . SER A 1 18 ? -2.711 76.818 38.101 1.00 34.01 ? 18 SER A N 1 ATOM 109 C CA . SER A 1 18 ? -4.000 77.218 38.669 1.00 34.01 ? 18 SER A CA 1 ATOM 110 C C . SER A 1 18 ? -3.930 77.775 40.092 1.00 39.11 ? 18 SER A C 1 ATOM 111 O O . SER A 1 18 ? -4.868 78.414 40.554 1.00 36.03 ? 18 SER A O 1 ATOM 112 C CB . SER A 1 18 ? -4.984 76.048 38.643 1.00 31.90 ? 18 SER A CB 1 ATOM 113 O OG . SER A 1 18 ? -4.585 75.031 39.542 1.00 31.90 ? 18 SER A OG 1 ATOM 114 N N . LYS A 1 19 ? -2.830 77.523 40.791 1.00 32.15 ? 19 LYS A N 1 ATOM 115 C CA . LYS A 1 19 ? -2.660 78.021 42.155 1.00 32.15 ? 19 LYS A CA 1 ATOM 116 C C . LYS A 1 19 ? -1.163 78.233 42.397 1.00 32.15 ? 19 LYS A C 1 ATOM 117 O O . LYS A 1 19 ? -0.502 77.469 43.109 1.00 32.15 ? 19 LYS A O 1 ATOM 118 C CB . LYS A 1 19 ? -3.244 77.022 43.158 1.00 32.37 ? 19 LYS A CB 1 ATOM 119 C CG . LYS A 1 19 ? -3.201 77.482 44.610 1.00 45.86 ? 19 LYS A CG 1 ATOM 120 C CD . LYS A 1 19 ? -3.889 76.476 45.540 1.00 47.15 ? 19 LYS A CD 1 ATOM 121 C CE . LYS A 1 19 ? -5.405 76.628 45.505 1.00 57.04 ? 19 LYS A CE 1 ATOM 122 N NZ . LYS A 1 19 ? -5.943 76.699 44.113 1.00 70.41 ? 19 LYS A NZ 1 ATOM 123 N N . HIS A 1 20 ? -0.640 79.285 41.782 1.00 39.59 ? 20 HIS A N 1 ATOM 124 C CA . HIS A 1 20 ? 0.769 79.602 41.882 1.00 39.59 ? 20 HIS A CA 1 ATOM 125 C C . HIS A 1 20 ? 1.145 80.022 43.293 1.00 42.83 ? 20 HIS A C 1 ATOM 126 O O . HIS A 1 20 ? 0.361 80.668 43.998 1.00 39.59 ? 20 HIS A O 1 ATOM 127 C CB . HIS A 1 20 ? 1.136 80.709 40.882 1.00 43.40 ? 20 HIS A CB 1 ATOM 128 C CG . HIS A 1 20 ? 0.761 82.084 41.338 1.00 47.61 ? 20 HIS A CG 1 ATOM 129 N ND1 . HIS A 1 20 ? 1.624 82.892 42.048 1.00 55.78 ? 20 HIS A ND1 1 ATOM 130 C CD2 . HIS A 1 20 ? -0.403 82.769 41.240 1.00 52.40 ? 20 HIS A CD2 1 ATOM 131 C CE1 . HIS A 1 20 ? 1.006 84.014 42.371 1.00 57.63 ? 20 HIS A CE1 1 ATOM 132 N NE2 . HIS A 1 20 ? -0.225 83.964 41.894 1.00 54.61 ? 20 HIS A NE2 1 ATOM 133 N N . VAL A 1 21 ? 2.354 79.624 43.684 1.00 40.82 ? 21 VAL A N 1 ATOM 134 C CA . VAL A 1 21 ? 2.927 79.931 44.979 1.00 42.04 ? 21 VAL A CA 1 ATOM 135 C C . VAL A 1 21 ? 3.638 81.280 44.863 1.00 44.43 ? 21 VAL A C 1 ATOM 136 O O . VAL A 1 21 ? 3.760 81.831 43.769 1.00 40.82 ? 21 VAL A O 1 ATOM 137 C CB . VAL A 1 21 ? 3.947 78.842 45.398 1.00 32.02 ? 21 VAL A CB 1 ATOM 138 C CG1 . VAL A 1 21 ? 3.282 77.482 45.384 1.00 32.02 ? 21 VAL A CG1 1 ATOM 139 C CG2 . VAL A 1 21 ? 5.152 78.845 44.462 1.00 32.02 ? 21 VAL A CG2 1 ATOM 140 N N . GLU A 1 22 ? 4.105 81.804 45.991 1.00 65.64 ? 22 GLU A N 1 ATOM 141 C CA . GLU A 1 22 ? 4.794 83.092 46.025 1.00 67.73 ? 22 GLU A CA 1 ATOM 142 C C . GLU A 1 22 ? 6.039 83.110 45.142 1.00 57.62 ? 22 GLU A C 1 ATOM 143 O O . GLU A 1 22 ? 6.815 82.152 45.131 1.00 64.91 ? 22 GLU A O 1 ATOM 144 C CB . GLU A 1 22 ? 5.203 83.427 47.463 1.00 99.79 ? 22 GLU A CB 1 ATOM 145 C CG . GLU A 1 22 ? 4.096 83.245 48.491 1.00 128.46 ? 22 GLU A CG 1 ATOM 146 C CD . GLU A 1 22 ? 2.930 84.191 48.279 1.00 139.97 ? 22 GLU A CD 1 ATOM 147 O OE1 . GLU A 1 22 ? 3.126 85.417 48.411 1.00 146.31 ? 22 GLU A OE1 1 ATOM 148 O OE2 . GLU A 1 22 ? 1.817 83.707 47.981 1.00 146.74 ? 22 GLU A OE2 1 ATOM 149 N N . ASP A 1 23 ? 6.220 84.204 44.405 1.00 49.21 ? 23 ASP A N 1 ATOM 150 C CA . ASP A 1 23 ? 7.381 84.384 43.531 1.00 54.06 ? 23 ASP A CA 1 ATOM 151 C C . ASP A 1 23 ? 7.361 83.595 42.227 1.00 50.31 ? 23 ASP A C 1 ATOM 152 O O . ASP A 1 23 ? 8.335 83.610 41.471 1.00 51.90 ? 23 ASP A O 1 ATOM 153 C CB . ASP A 1 23 ? 8.674 84.077 44.290 1.00 111.11 ? 23 ASP A CB 1 ATOM 154 C CG . ASP A 1 23 ? 8.888 85.010 45.465 1.00 127.73 ? 23 ASP A CG 1 ATOM 155 O OD1 . ASP A 1 23 ? 8.864 86.243 45.256 1.00 125.42 ? 23 ASP A OD1 1 ATOM 156 O OD2 . ASP A 1 23 ? 9.078 84.513 46.596 1.00 132.11 ? 23 ASP A OD2 1 ATOM 157 N N . VAL A 1 24 ? 6.253 82.907 41.970 1.00 35.43 ? 24 VAL A N 1 ATOM 158 C CA . VAL A 1 24 ? 6.091 82.142 40.747 1.00 30.60 ? 24 VAL A CA 1 ATOM 159 C C . VAL A 1 24 ? 4.874 82.677 40.002 1.00 30.60 ? 24 VAL A C 1 ATOM 160 O O . VAL A 1 24 ? 3.749 82.610 40.501 1.00 30.60 ? 24 VAL A O 1 ATOM 161 C CB . VAL A 1 24 ? 5.881 80.648 41.042 1.00 47.25 ? 24 VAL A CB 1 ATOM 162 C CG1 . VAL A 1 24 ? 5.633 79.885 39.742 1.00 47.25 ? 24 VAL A CG1 1 ATOM 163 C CG2 . VAL A 1 24 ? 7.098 80.096 41.750 1.00 47.25 ? 24 VAL A CG2 1 ATOM 164 N N . PRO A 1 25 ? 5.090 83.244 38.807 1.00 34.92 ? 25 PRO A N 1 ATOM 165 C CA . PRO A 1 25 ? 3.974 83.783 38.025 1.00 34.92 ? 25 PRO A CA 1 ATOM 166 C C . PRO A 1 25 ? 2.971 82.726 37.582 1.00 34.92 ? 25 PRO A C 1 ATOM 167 O O . PRO A 1 25 ? 3.350 81.613 37.222 1.00 34.92 ? 25 PRO A O 1 ATOM 168 C CB . PRO A 1 25 ? 4.670 84.478 36.847 1.00 32.54 ? 25 PRO A CB 1 ATOM 169 C CG . PRO A 1 25 ? 6.001 83.780 36.761 1.00 42.22 ? 25 PRO A CG 1 ATOM 170 C CD . PRO A 1 25 ? 6.380 83.605 38.198 1.00 32.54 ? 25 PRO A CD 1 ATOM 171 N N . ALA A 1 26 ? 1.691 83.073 37.625 1.00 31.88 ? 26 ALA A N 1 ATOM 172 C CA . ALA A 1 26 ? 0.642 82.156 37.224 1.00 31.88 ? 26 ALA A CA 1 ATOM 173 C C . ALA A 1 26 ? 0.771 81.784 35.742 1.00 31.88 ? 26 ALA A C 1 ATOM 174 O O . ALA A 1 26 ? 0.476 80.647 35.355 1.00 31.88 ? 26 ALA A O 1 ATOM 175 C CB . ALA A 1 26 ? -0.736 82.791 37.490 1.00 6.96 ? 26 ALA A CB 1 ATOM 176 N N . PHE A 1 27 ? 1.220 82.738 34.926 1.00 22.06 ? 27 PHE A N 1 ATOM 177 C CA . PHE A 1 27 ? 1.362 82.526 33.492 1.00 22.06 ? 27 PHE A CA 1 ATOM 178 C C . PHE A 1 27 ? 2.734 82.902 32.938 1.00 22.06 ? 27 PHE A C 1 ATOM 179 O O . PHE A 1 27 ? 3.277 83.948 33.254 1.00 22.06 ? 27 PHE A O 1 ATOM 180 C CB . PHE A 1 27 ? 0.294 83.335 32.748 1.00 30.36 ? 27 PHE A CB 1 ATOM 181 C CG . PHE A 1 27 ? 0.294 83.119 31.264 1.00 30.36 ? 27 PHE A CG 1 ATOM 182 C CD1 . PHE A 1 27 ? -0.177 81.927 30.720 1.00 30.36 ? 27 PHE A CD1 1 ATOM 183 C CD2 . PHE A 1 27 ? 0.769 84.102 30.405 1.00 30.36 ? 27 PHE A CD2 1 ATOM 184 C CE1 . PHE A 1 27 ? -0.177 81.717 29.331 1.00 30.36 ? 27 PHE A CE1 1 ATOM 185 C CE2 . PHE A 1 27 ? 0.774 83.906 29.013 1.00 30.36 ? 27 PHE A CE2 1 ATOM 186 C CZ . PHE A 1 27 ? 0.300 82.713 28.475 1.00 30.36 ? 27 PHE A CZ 1 ATOM 187 N N . GLN A 1 28 ? 3.287 82.049 32.091 1.00 26.97 ? 28 GLN A N 1 ATOM 188 C CA . GLN A 1 28 ? 4.586 82.318 31.486 1.00 26.97 ? 28 GLN A CA 1 ATOM 189 C C . GLN A 1 28 ? 4.585 81.885 30.027 1.00 26.97 ? 28 GLN A C 1 ATOM 190 O O . GLN A 1 28 ? 4.039 80.840 29.664 1.00 26.97 ? 28 GLN A O 1 ATOM 191 C CB . GLN A 1 28 ? 5.704 81.602 32.254 1.00 32.78 ? 28 GLN A CB 1 ATOM 192 C CG . GLN A 1 28 ? 6.110 82.347 33.513 1.00 35.16 ? 28 GLN A CG 1 ATOM 193 C CD . GLN A 1 28 ? 7.004 81.543 34.447 1.00 41.74 ? 28 GLN A CD 1 ATOM 194 O OE1 . GLN A 1 28 ? 6.541 80.632 35.146 1.00 47.36 ? 28 GLN A OE1 1 ATOM 195 N NE2 . GLN A 1 28 ? 8.294 81.879 34.466 1.00 39.46 ? 28 GLN A NE2 1 ATOM 196 N N . ALA A 1 29 ? 5.174 82.719 29.187 1.00 32.78 ? 29 ALA A N 1 ATOM 197 C CA . ALA A 1 29 ? 5.267 82.432 27.767 1.00 32.78 ? 29 ALA A CA 1 ATOM 198 C C . ALA A 1 29 ? 6.695 82.697 27.392 1.00 32.78 ? 29 ALA A C 1 ATOM 199 O O . ALA A 1 29 ? 7.362 83.523 28.013 1.00 32.78 ? 29 ALA A O 1 ATOM 200 C CB . ALA A 1 29 ? 4.355 83.348 26.974 1.00 19.08 ? 29 ALA A CB 1 ATOM 201 N N . LEU A 1 30 ? 7.174 81.979 26.393 1.00 28.54 ? 30 LEU A N 1 ATOM 202 C CA . LEU A 1 30 ? 8.533 82.166 25.917 1.00 28.54 ? 30 LEU A CA 1 ATOM 203 C C . LEU A 1 30 ? 8.521 81.739 24.456 1.00 28.54 ? 30 LEU A C 1 ATOM 204 O O . LEU A 1 30 ? 7.621 81.016 24.019 1.00 28.54 ? 30 LEU A O 1 ATOM 205 C CB . LEU A 1 30 ? 9.510 81.321 26.735 1.00 31.26 ? 30 LEU A CB 1 ATOM 206 C CG . LEU A 1 30 ? 9.421 79.805 26.587 1.00 37.35 ? 30 LEU A CG 1 ATOM 207 C CD1 . LEU A 1 30 ? 10.102 79.375 25.276 1.00 37.91 ? 30 LEU A CD1 1 ATOM 208 C CD2 . LEU A 1 30 ? 10.098 79.152 27.765 1.00 37.02 ? 30 LEU A CD2 1 ATOM 209 N N . GLY A 1 31 ? 9.502 82.201 23.696 1.00 26.70 ? 31 GLY A N 1 ATOM 210 C CA . GLY A 1 31 ? 9.541 81.849 22.295 1.00 26.70 ? 31 GLY A CA 1 ATOM 211 C C . GLY A 1 31 ? 10.946 81.551 21.841 1.00 26.70 ? 31 GLY A C 1 ATOM 212 O O . GLY A 1 31 ? 11.917 82.117 22.350 1.00 26.70 ? 31 GLY A O 1 ATOM 213 N N . SER A 1 32 ? 11.064 80.655 20.874 1.00 28.29 ? 32 SER A N 1 ATOM 214 C CA . SER A 1 32 ? 12.377 80.310 20.370 1.00 28.29 ? 32 SER A CA 1 ATOM 215 C C . SER A 1 32 ? 12.459 80.321 18.851 1.00 28.29 ? 32 SER A C 1 ATOM 216 O O . SER A 1 32 ? 11.462 80.132 18.140 1.00 28.29 ? 32 SER A O 1 ATOM 217 C CB . SER A 1 32 ? 12.783 78.934 20.884 1.00 45.39 ? 32 SER A CB 1 ATOM 218 O OG . SER A 1 32 ? 12.790 78.921 22.297 1.00 48.45 ? 32 SER A OG 1 ATOM 219 N N . LEU A 1 33 ? 13.671 80.574 18.378 1.00 32.48 ? 33 LEU A N 1 ATOM 220 C CA . LEU A 1 33 ? 14.003 80.554 16.966 1.00 32.48 ? 33 LEU A CA 1 ATOM 221 C C . LEU A 1 33 ? 15.180 79.598 16.988 1.00 32.48 ? 33 LEU A C 1 ATOM 222 O O . LEU A 1 33 ? 16.253 79.907 17.518 1.00 32.48 ? 33 LEU A O 1 ATOM 223 C CB . LEU A 1 33 ? 14.386 81.958 16.463 1.00 21.50 ? 33 LEU A CB 1 ATOM 224 C CG . LEU A 1 33 ? 13.091 82.771 16.248 1.00 21.50 ? 33 LEU A CG 1 ATOM 225 C CD1 . LEU A 1 33 ? 13.343 84.283 16.289 1.00 21.50 ? 33 LEU A CD1 1 ATOM 226 C CD2 . LEU A 1 33 ? 12.463 82.323 14.934 1.00 21.50 ? 33 LEU A CD2 1 ATOM 227 N N . ASN A 1 34 ? 14.952 78.404 16.460 1.00 28.31 ? 34 ASN A N 1 ATOM 228 C CA . ASN A 1 34 ? 15.985 77.389 16.470 1.00 28.31 ? 34 ASN A CA 1 ATOM 229 C C . ASN A 1 34 ? 16.365 77.090 17.921 1.00 28.31 ? 34 ASN A C 1 ATOM 230 O O . ASN A 1 34 ? 15.500 76.843 18.746 1.00 28.31 ? 34 ASN A O 1 ATOM 231 C CB . ASN A 1 34 ? 17.196 77.867 15.670 1.00 35.96 ? 34 ASN A CB 1 ATOM 232 C CG . ASN A 1 34 ? 16.943 77.815 14.174 1.00 41.22 ? 34 ASN A CG 1 ATOM 233 O OD1 . ASN A 1 34 ? 15.820 77.522 13.732 1.00 35.96 ? 34 ASN A OD1 1 ATOM 234 N ND2 . ASN A 1 34 ? 17.976 78.093 13.384 1.00 35.96 ? 34 ASN A ND2 1 ATOM 235 N N . ASP A 1 35 ? 17.649 77.146 18.232 1.00 26.70 ? 35 ASP A N 1 ATOM 236 C CA . ASP A 1 35 ? 18.137 76.836 19.570 1.00 26.70 ? 35 ASP A CA 1 ATOM 237 C C . ASP A 1 35 ? 18.247 78.042 20.504 1.00 26.70 ? 35 ASP A C 1 ATOM 238 O O . ASP A 1 35 ? 18.837 77.938 21.586 1.00 26.70 ? 35 ASP A O 1 ATOM 239 C CB . ASP A 1 35 ? 19.511 76.183 19.442 1.00 36.40 ? 35 ASP A CB 1 ATOM 240 C CG . ASP A 1 35 ? 20.529 77.089 18.745 1.00 38.77 ? 35 ASP A CG 1 ATOM 241 O OD1 . ASP A 1 35 ? 20.129 77.955 17.945 1.00 36.40 ? 35 ASP A OD1 1 ATOM 242 O OD2 . ASP A 1 35 ? 21.740 76.933 18.990 1.00 36.40 ? 35 ASP A OD2 1 ATOM 243 N N . LEU A 1 36 ? 17.678 79.175 20.097 1.00 28.17 ? 36 LEU A N 1 ATOM 244 C CA . LEU A 1 36 ? 17.776 80.394 20.894 1.00 28.17 ? 36 LEU A CA 1 ATOM 245 C C . LEU A 1 36 ? 16.443 80.974 21.318 1.00 28.17 ? 36 LEU A C 1 ATOM 246 O O . LEU A 1 36 ? 15.459 80.878 20.590 1.00 28.17 ? 36 LEU A O 1 ATOM 247 C CB . LEU A 1 36 ? 18.543 81.454 20.102 1.00 30.07 ? 36 LEU A CB 1 ATOM 248 C CG . LEU A 1 36 ? 19.944 81.075 19.611 1.00 30.07 ? 36 LEU A CG 1 ATOM 249 C CD1 . LEU A 1 36 ? 20.489 82.197 18.705 1.00 30.07 ? 36 LEU A CD1 1 ATOM 250 C CD2 . LEU A 1 36 ? 20.857 80.859 20.822 1.00 30.07 ? 36 LEU A CD2 1 ATOM 251 N N . GLN A 1 37 ? 16.414 81.583 22.499 1.00 36.60 ? 37 GLN A N 1 ATOM 252 C CA . GLN A 1 37 ? 15.193 82.194 22.992 1.00 36.60 ? 37 GLN A CA 1 ATOM 253 C C . GLN A 1 37 ? 15.250 83.679 22.641 1.00 36.60 ? 37 GLN A C 1 ATOM 254 O O . GLN A 1 37 ? 16.222 84.363 22.969 1.00 36.60 ? 37 GLN A O 1 ATOM 255 C CB . GLN A 1 37 ? 15.065 82.005 24.505 1.00 26.55 ? 37 GLN A CB 1 ATOM 256 C CG . GLN A 1 37 ? 13.813 82.643 25.077 1.00 26.55 ? 37 GLN A CG 1 ATOM 257 C CD . GLN A 1 37 ? 13.534 82.241 26.518 1.00 36.05 ? 37 GLN A CD 1 ATOM 258 O OE1 . GLN A 1 37 ? 12.702 82.855 27.188 1.00 29.11 ? 37 GLN A OE1 1 ATOM 259 N NE2 . GLN A 1 37 ? 14.217 81.207 26.999 1.00 27.88 ? 37 GLN A NE2 1 ATOM 260 N N . PHE A 1 38 ? 14.214 84.177 21.968 1.00 32.79 ? 38 PHE A N 1 ATOM 261 C CA . PHE A 1 38 ? 14.200 85.575 21.568 1.00 32.79 ? 38 PHE A CA 1 ATOM 262 C C . PHE A 1 38 ? 13.287 86.445 22.405 1.00 32.79 ? 38 PHE A C 1 ATOM 263 O O . PHE A 1 38 ? 13.415 87.666 22.367 1.00 32.79 ? 38 PHE A O 1 ATOM 264 C CB . PHE A 1 38 ? 13.830 85.707 20.084 1.00 22.86 ? 38 PHE A CB 1 ATOM 265 C CG . PHE A 1 38 ? 12.408 85.329 19.771 1.00 22.86 ? 38 PHE A CG 1 ATOM 266 C CD1 . PHE A 1 38 ? 11.398 86.297 19.773 1.00 22.86 ? 38 PHE A CD1 1 ATOM 267 C CD2 . PHE A 1 38 ? 12.076 84.000 19.461 1.00 22.86 ? 38 PHE A CD2 1 ATOM 268 C CE1 . PHE A 1 38 ? 10.078 85.954 19.464 1.00 22.86 ? 38 PHE A CE1 1 ATOM 269 C CE2 . PHE A 1 38 ? 10.763 83.646 19.153 1.00 22.86 ? 38 PHE A CE2 1 ATOM 270 C CZ . PHE A 1 38 ? 9.759 84.625 19.153 1.00 22.86 ? 38 PHE A CZ 1 ATOM 271 N N . PHE A 1 39 ? 12.363 85.846 23.152 1.00 27.28 ? 39 PHE A N 1 ATOM 272 C CA . PHE A 1 39 ? 11.493 86.669 23.988 1.00 27.28 ? 39 PHE A CA 1 ATOM 273 C C . PHE A 1 39 ? 10.876 85.921 25.159 1.00 27.28 ? 39 PHE A C 1 ATOM 274 O O . PHE A 1 39 ? 10.964 84.703 25.241 1.00 27.28 ? 39 PHE A O 1 ATOM 275 C CB . PHE A 1 39 ? 10.383 87.310 23.141 1.00 30.00 ? 39 PHE A CB 1 ATOM 276 C CG . PHE A 1 39 ? 9.042 86.666 23.313 1.00 30.00 ? 39 PHE A CG 1 ATOM 277 C CD1 . PHE A 1 39 ? 8.795 85.386 22.804 1.00 30.00 ? 39 PHE A CD1 1 ATOM 278 C CD2 . PHE A 1 39 ? 8.042 87.312 24.036 1.00 30.00 ? 39 PHE A CD2 1 ATOM 279 C CE1 . PHE A 1 39 ? 7.565 84.756 23.023 1.00 30.00 ? 39 PHE A CE1 1 ATOM 280 C CE2 . PHE A 1 39 ? 6.806 86.695 24.262 1.00 30.00 ? 39 PHE A CE2 1 ATOM 281 C CZ . PHE A 1 39 ? 6.568 85.414 23.757 1.00 30.00 ? 39 PHE A CZ 1 ATOM 282 N N . ARG A 1 40 ? 10.240 86.655 26.061 1.00 29.48 ? 40 ARG A N 1 ATOM 283 C CA . ARG A 1 40 ? 9.606 86.039 27.216 1.00 29.48 ? 40 ARG A CA 1 ATOM 284 C C . ARG A 1 40 ? 8.513 86.954 27.730 1.00 29.48 ? 40 ARG A C 1 ATOM 285 O O . ARG A 1 40 ? 8.499 88.145 27.424 1.00 29.48 ? 40 ARG A O 1 ATOM 286 C CB . ARG A 1 40 ? 10.622 85.820 28.336 1.00 40.29 ? 40 ARG A CB 1 ATOM 287 C CG . ARG A 1 40 ? 10.995 87.102 29.046 1.00 46.70 ? 40 ARG A CG 1 ATOM 288 C CD . ARG A 1 40 ? 12.029 86.880 30.114 1.00 53.53 ? 40 ARG A CD 1 ATOM 289 N NE . ARG A 1 40 ? 12.503 88.161 30.621 1.00 63.06 ? 40 ARG A NE 1 ATOM 290 C CZ . ARG A 1 40 ? 13.452 88.298 31.537 1.00 74.91 ? 40 ARG A CZ 1 ATOM 291 N NH1 . ARG A 1 40 ? 14.035 87.224 32.055 1.00 74.02 ? 40 ARG A NH1 1 ATOM 292 N NH2 . ARG A 1 40 ? 13.824 89.510 31.928 1.00 78.25 ? 40 ARG A NH2 1 ATOM 293 N N . TYR A 1 41 ? 7.615 86.401 28.533 1.00 26.44 ? 41 TYR A N 1 ATOM 294 C CA . TYR A 1 41 ? 6.529 87.186 29.090 1.00 26.44 ? 41 TYR A CA 1 ATOM 295 C C . TYR A 1 41 ? 5.892 86.454 30.256 1.00 26.44 ? 41 TYR A C 1 ATOM 296 O O . TYR A 1 41 ? 5.624 85.254 30.152 1.00 26.44 ? 41 TYR A O 1 ATOM 297 C CB . TYR A 1 41 ? 5.470 87.454 28.009 1.00 26.18 ? 41 TYR A CB 1 ATOM 298 C CG . TYR A 1 41 ? 4.158 87.997 28.541 1.00 26.18 ? 41 TYR A CG 1 ATOM 299 C CD1 . TYR A 1 41 ? 3.248 87.171 29.208 1.00 26.18 ? 41 TYR A CD1 1 ATOM 300 C CD2 . TYR A 1 41 ? 3.829 89.342 28.385 1.00 26.18 ? 41 TYR A CD2 1 ATOM 301 C CE1 . TYR A 1 41 ? 2.037 87.677 29.707 1.00 26.18 ? 41 TYR A CE1 1 ATOM 302 C CE2 . TYR A 1 41 ? 2.631 89.853 28.871 1.00 26.18 ? 41 TYR A CE2 1 ATOM 303 C CZ . TYR A 1 41 ? 1.743 89.021 29.524 1.00 26.18 ? 41 TYR A CZ 1 ATOM 304 O OH . TYR A 1 41 ? 0.542 89.536 29.946 1.00 26.18 ? 41 TYR A OH 1 ATOM 305 N N . ASN A 1 42 ? 5.657 87.148 31.366 1.00 27.01 ? 42 ASN A N 1 ATOM 306 C CA . ASN A 1 42 ? 4.996 86.494 32.490 1.00 27.01 ? 42 ASN A CA 1 ATOM 307 C C . ASN A 1 42 ? 3.848 87.349 32.983 1.00 27.01 ? 42 ASN A C 1 ATOM 308 O O . ASN A 1 42 ? 3.771 88.542 32.677 1.00 27.01 ? 42 ASN A O 1 ATOM 309 C CB . ASN A 1 42 ? 5.965 86.196 33.641 1.00 27.25 ? 42 ASN A CB 1 ATOM 310 C CG . ASN A 1 42 ? 6.477 87.443 34.320 1.00 29.01 ? 42 ASN A CG 1 ATOM 311 O OD1 . ASN A 1 42 ? 5.717 88.205 34.921 1.00 29.33 ? 42 ASN A OD1 1 ATOM 312 N ND2 . ASN A 1 42 ? 7.785 87.658 34.228 1.00 28.30 ? 42 ASN A ND2 1 ATOM 313 N N . SER A 1 43 ? 2.954 86.732 33.747 1.00 30.92 ? 43 SER A N 1 ATOM 314 C CA . SER A 1 43 ? 1.790 87.434 34.259 1.00 30.92 ? 43 SER A CA 1 ATOM 315 C C . SER A 1 43 ? 2.077 88.387 35.425 1.00 33.32 ? 43 SER A C 1 ATOM 316 O O . SER A 1 43 ? 1.162 89.025 35.946 1.00 31.46 ? 43 SER A O 1 ATOM 317 C CB . SER A 1 43 ? 0.712 86.420 34.645 1.00 23.60 ? 43 SER A CB 1 ATOM 318 O OG . SER A 1 43 ? 1.172 85.562 35.665 1.00 23.60 ? 43 SER A OG 1 ATOM 319 N N . LYS A 1 44 ? 3.336 88.485 35.840 1.00 34.89 ? 44 LYS A N 1 ATOM 320 C CA . LYS A 1 44 ? 3.692 89.399 36.925 1.00 43.99 ? 44 LYS A CA 1 ATOM 321 C C . LYS A 1 44 ? 4.035 90.759 36.311 1.00 42.48 ? 44 LYS A C 1 ATOM 322 O O . LYS A 1 44 ? 3.388 91.762 36.598 1.00 44.23 ? 44 LYS A O 1 ATOM 323 C CB . LYS A 1 44 ? 4.897 88.885 37.713 1.00 60.00 ? 44 LYS A CB 1 ATOM 324 C CG . LYS A 1 44 ? 5.300 89.814 38.843 1.00 75.22 ? 44 LYS A CG 1 ATOM 325 C CD . LYS A 1 44 ? 6.675 89.481 39.390 1.00 84.23 ? 44 LYS A CD 1 ATOM 326 C CE . LYS A 1 44 ? 7.113 90.498 40.443 1.00 92.59 ? 44 LYS A CE 1 ATOM 327 N NZ . LYS A 1 44 ? 8.531 90.298 40.874 1.00 90.55 ? 44 LYS A NZ 1 ATOM 328 N N . ASP A 1 45 ? 5.046 90.779 35.449 1.00 40.23 ? 45 ASP A N 1 ATOM 329 C CA . ASP A 1 45 ? 5.463 92.009 34.789 1.00 41.90 ? 45 ASP A CA 1 ATOM 330 C C . ASP A 1 45 ? 4.585 92.342 33.573 1.00 46.58 ? 45 ASP A C 1 ATOM 331 O O . ASP A 1 45 ? 4.546 93.484 33.128 1.00 39.09 ? 45 ASP A O 1 ATOM 332 C CB . ASP A 1 45 ? 6.929 91.898 34.348 1.00 99.54 ? 45 ASP A CB 1 ATOM 333 C CG . ASP A 1 45 ? 7.846 91.420 35.465 1.00 112.79 ? 45 ASP A CG 1 ATOM 334 O OD1 . ASP A 1 45 ? 7.694 91.894 36.613 1.00 109.61 ? 45 ASP A OD1 1 ATOM 335 O OD2 . ASP A 1 45 ? 8.728 90.577 35.192 1.00 121.08 ? 45 ASP A OD2 1 ATOM 336 N N . ARG A 1 46 ? 3.890 91.338 33.043 1.00 40.93 ? 46 ARG A N 1 ATOM 337 C CA . ARG A 1 46 ? 3.016 91.489 31.873 1.00 37.06 ? 46 ARG A CA 1 ATOM 338 C C . ARG A 1 46 ? 3.639 92.255 30.703 1.00 40.03 ? 46 ARG A C 1 ATOM 339 O O . ARG A 1 46 ? 2.971 93.076 30.097 1.00 38.14 ? 46 ARG A O 1 ATOM 340 C CB . ARG A 1 46 ? 1.704 92.167 32.271 1.00 44.63 ? 46 ARG A CB 1 ATOM 341 C CG . ARG A 1 46 ? 1.092 91.612 33.544 1.00 59.26 ? 46 ARG A CG 1 ATOM 342 C CD . ARG A 1 46 ? -0.269 92.224 33.831 1.00 60.36 ? 46 ARG A CD 1 ATOM 343 N NE . ARG A 1 46 ? -1.353 91.510 33.164 1.00 61.22 ? 46 ARG A NE 1 ATOM 344 C CZ . ARG A 1 46 ? -1.829 90.326 33.549 1.00 69.90 ? 46 ARG A CZ 1 ATOM 345 N NH1 . ARG A 1 46 ? -1.325 89.695 34.610 1.00 47.34 ? 46 ARG A NH1 1 ATOM 346 N NH2 . ARG A 1 46 ? -2.821 89.766 32.868 1.00 76.93 ? 46 ARG A NH2 1 ATOM 347 N N . LYS A 1 47 ? 4.906 91.979 30.380 1.00 45.84 ? 47 LYS A N 1 ATOM 348 C CA . LYS A 1 47 ? 5.591 92.655 29.267 1.00 46.92 ? 47 LYS A CA 1 ATOM 349 C C . LYS A 1 47 ? 6.375 91.711 28.346 1.00 48.32 ? 47 LYS A C 1 ATOM 350 O O . LYS A 1 47 ? 7.197 90.933 28.814 1.00 45.84 ? 47 LYS A O 1 ATOM 351 C CB . LYS A 1 47 ? 6.544 93.733 29.807 1.00 63.79 ? 47 LYS A CB 1 ATOM 352 C CG . LYS A 1 47 ? 5.837 94.946 30.392 1.00 68.67 ? 47 LYS A CG 1 ATOM 353 C CD . LYS A 1 47 ? 4.873 95.540 29.364 1.00 82.25 ? 47 LYS A CD 1 ATOM 354 C CE . LYS A 1 47 ? 3.727 96.311 30.014 1.00 86.86 ? 47 LYS A CE 1 ATOM 355 N NZ . LYS A 1 47 ? 2.666 96.642 29.013 1.00 83.11 ? 47 LYS A NZ 1 ATOM 356 N N . SER A 1 48 ? 6.118 91.772 27.042 1.00 48.32 ? 48 SER A N 1 ATOM 357 C CA . SER A 1 48 ? 6.845 90.924 26.096 1.00 49.24 ? 48 SER A CA 1 ATOM 358 C C . SER A 1 48 ? 8.194 91.574 25.911 1.00 52.09 ? 48 SER A C 1 ATOM 359 O O . SER A 1 48 ? 8.281 92.692 25.412 1.00 52.02 ? 48 SER A O 1 ATOM 360 C CB . SER A 1 48 ? 6.138 90.860 24.748 1.00 39.26 ? 48 SER A CB 1 ATOM 361 O OG . SER A 1 48 ? 4.792 90.483 24.929 1.00 47.72 ? 48 SER A OG 1 ATOM 362 N N . GLN A 1 49 ? 9.249 90.872 26.298 1.00 36.96 ? 49 GLN A N 1 ATOM 363 C CA . GLN A 1 49 ? 10.580 91.433 26.206 1.00 39.21 ? 49 GLN A CA 1 ATOM 364 C C . GLN A 1 49 ? 11.516 90.644 25.331 1.00 39.19 ? 49 GLN A C 1 ATOM 365 O O . GLN A 1 49 ? 11.596 89.424 25.430 1.00 37.27 ? 49 GLN A O 1 ATOM 366 C CB . GLN A 1 49 ? 11.193 91.526 27.598 1.00 55.11 ? 49 GLN A CB 1 ATOM 367 C CG . GLN A 1 49 ? 10.253 92.064 28.641 1.00 66.62 ? 49 GLN A CG 1 ATOM 368 C CD . GLN A 1 49 ? 10.882 92.091 30.010 1.00 74.33 ? 49 GLN A CD 1 ATOM 369 O OE1 . GLN A 1 49 ? 11.204 91.046 30.584 1.00 80.14 ? 49 GLN A OE1 1 ATOM 370 N NE2 . GLN A 1 49 ? 11.072 93.291 30.545 1.00 77.00 ? 49 GLN A NE2 1 ATOM 371 N N . PRO A 1 50 ? 12.244 91.331 24.449 1.00 38.55 ? 50 PRO A N 1 ATOM 372 C CA . PRO A 1 50 ? 13.156 90.546 23.622 1.00 38.55 ? 50 PRO A CA 1 ATOM 373 C C . PRO A 1 50 ? 14.231 90.007 24.554 1.00 38.55 ? 50 PRO A C 1 ATOM 374 O O . PRO A 1 50 ? 14.417 90.525 25.645 1.00 38.55 ? 50 PRO A O 1 ATOM 375 C CB . PRO A 1 50 ? 13.692 91.576 22.631 1.00 16.99 ? 50 PRO A CB 1 ATOM 376 C CG . PRO A 1 50 ? 13.639 92.844 23.408 1.00 20.61 ? 50 PRO A CG 1 ATOM 377 C CD . PRO A 1 50 ? 12.316 92.763 24.108 1.00 17.74 ? 50 PRO A CD 1 ATOM 378 N N . MET A 1 51 ? 14.917 88.962 24.118 1.00 25.97 ? 51 MET A N 1 ATOM 379 C CA . MET A 1 51 ? 15.976 88.342 24.894 1.00 25.97 ? 51 MET A CA 1 ATOM 380 C C . MET A 1 51 ? 17.157 88.015 24.005 1.00 25.97 ? 51 MET A C 1 ATOM 381 O O . MET A 1 51 ? 17.028 87.979 22.777 1.00 25.97 ? 51 MET A O 1 ATOM 382 C CB . MET A 1 51 ? 15.473 87.063 25.551 1.00 48.39 ? 51 MET A CB 1 ATOM 383 C CG . MET A 1 51 ? 14.619 87.300 26.766 1.00 50.66 ? 51 MET A CG 1 ATOM 384 S SD . MET A 1 51 ? 13.929 85.750 27.317 1.00 66.02 ? 51 MET A SD 1 ATOM 385 C CE . MET A 1 51 ? 15.361 85.004 28.149 1.00 65.23 ? 51 MET A CE 1 ATOM 386 N N . GLY A 1 52 ? 18.303 87.769 24.635 1.00 44.56 ? 52 GLY A N 1 ATOM 387 C CA . GLY A 1 52 ? 19.503 87.442 23.890 1.00 44.56 ? 52 GLY A CA 1 ATOM 388 C C . GLY A 1 52 ? 19.894 88.526 22.906 1.00 44.56 ? 52 GLY A C 1 ATOM 389 O O . GLY A 1 52 ? 19.653 89.715 23.136 1.00 44.56 ? 52 GLY A O 1 ATOM 390 N N . LEU A 1 53 ? 20.488 88.114 21.793 1.00 47.82 ? 53 LEU A N 1 ATOM 391 C CA . LEU A 1 53 ? 20.930 89.058 20.778 1.00 47.82 ? 53 LEU A CA 1 ATOM 392 C C . LEU A 1 53 ? 19.792 89.843 20.146 1.00 53.07 ? 53 LEU A C 1 ATOM 393 O O . LEU A 1 53 ? 20.032 90.751 19.351 1.00 50.02 ? 53 LEU A O 1 ATOM 394 C CB . LEU A 1 53 ? 21.715 88.332 19.692 1.00 28.05 ? 53 LEU A CB 1 ATOM 395 C CG . LEU A 1 53 ? 22.987 87.634 20.178 1.00 31.35 ? 53 LEU A CG 1 ATOM 396 C CD1 . LEU A 1 53 ? 23.552 86.763 19.052 1.00 28.05 ? 53 LEU A CD1 1 ATOM 397 C CD2 . LEU A 1 53 ? 24.007 88.670 20.630 1.00 30.23 ? 53 LEU A CD2 1 ATOM 398 N N . TRP A 1 54 ? 18.557 89.496 20.487 1.00 36.06 ? 54 TRP A N 1 ATOM 399 C CA . TRP A 1 54 ? 17.418 90.212 19.938 1.00 35.56 ? 54 TRP A CA 1 ATOM 400 C C . TRP A 1 54 ? 17.171 91.516 20.688 1.00 35.56 ? 54 TRP A C 1 ATOM 401 O O . TRP A 1 54 ? 16.435 92.380 20.212 1.00 35.84 ? 54 TRP A O 1 ATOM 402 C CB . TRP A 1 54 ? 16.173 89.330 19.967 1.00 36.39 ? 54 TRP A CB 1 ATOM 403 C CG . TRP A 1 54 ? 16.141 88.386 18.812 1.00 36.39 ? 54 TRP A CG 1 ATOM 404 C CD1 . TRP A 1 54 ? 15.786 88.682 17.532 1.00 36.39 ? 54 TRP A CD1 1 ATOM 405 C CD2 . TRP A 1 54 ? 16.583 87.020 18.803 1.00 36.39 ? 54 TRP A CD2 1 ATOM 406 N NE1 . TRP A 1 54 ? 15.984 87.594 16.722 1.00 36.39 ? 54 TRP A NE1 1 ATOM 407 C CE2 . TRP A 1 54 ? 16.471 86.558 17.473 1.00 36.39 ? 54 TRP A CE2 1 ATOM 408 C CE3 . TRP A 1 54 ? 17.066 86.145 19.790 1.00 36.39 ? 54 TRP A CE3 1 ATOM 409 C CZ2 . TRP A 1 54 ? 16.823 85.258 17.098 1.00 36.39 ? 54 TRP A CZ2 1 ATOM 410 C CZ3 . TRP A 1 54 ? 17.418 84.854 19.424 1.00 36.39 ? 54 TRP A CZ3 1 ATOM 411 C CH2 . TRP A 1 54 ? 17.294 84.420 18.084 1.00 36.39 ? 54 TRP A CH2 1 ATOM 412 N N . ARG A 1 55 ? 17.784 91.662 21.860 1.00 40.08 ? 55 ARG A N 1 ATOM 413 C CA . ARG A 1 55 ? 17.634 92.893 22.622 1.00 44.51 ? 55 ARG A CA 1 ATOM 414 C C . ARG A 1 55 ? 18.268 94.047 21.842 1.00 45.41 ? 55 ARG A C 1 ATOM 415 O O . ARG A 1 55 ? 18.015 95.214 22.132 1.00 48.59 ? 55 ARG A O 1 ATOM 416 C CB . ARG A 1 55 ? 18.311 92.762 23.985 1.00 46.18 ? 55 ARG A CB 1 ATOM 417 C CG . ARG A 1 55 ? 17.547 91.897 24.971 1.00 44.77 ? 55 ARG A CG 1 ATOM 418 C CD . ARG A 1 55 ? 18.381 91.615 26.197 1.00 37.98 ? 55 ARG A CD 1 ATOM 419 N NE . ARG A 1 55 ? 19.550 90.806 25.864 1.00 45.75 ? 55 ARG A NE 1 ATOM 420 C CZ . ARG A 1 55 ? 20.551 90.553 26.701 1.00 53.80 ? 55 ARG A CZ 1 ATOM 421 N NH1 . ARG A 1 55 ? 20.534 91.053 27.931 1.00 53.00 ? 55 ARG A NH1 1 ATOM 422 N NH2 . ARG A 1 55 ? 21.560 89.781 26.315 1.00 53.83 ? 55 ARG A NH2 1 ATOM 423 N N . GLN A 1 56 ? 19.087 93.706 20.850 1.00 56.97 ? 56 GLN A N 1 ATOM 424 C CA . GLN A 1 56 ? 19.768 94.693 20.019 1.00 68.76 ? 56 GLN A CA 1 ATOM 425 C C . GLN A 1 56 ? 19.193 94.808 18.614 1.00 69.55 ? 56 GLN A C 1 ATOM 426 O O . GLN A 1 56 ? 19.667 95.616 17.821 1.00 73.71 ? 56 GLN A O 1 ATOM 427 C CB . GLN A 1 56 ? 21.250 94.351 19.885 1.00 77.71 ? 56 GLN A CB 1 ATOM 428 C CG . GLN A 1 56 ? 22.058 94.457 21.157 1.00 93.88 ? 56 GLN A CG 1 ATOM 429 C CD . GLN A 1 56 ? 23.527 94.149 20.917 1.00 106.74 ? 56 GLN A CD 1 ATOM 430 O OE1 . GLN A 1 56 ? 23.886 93.033 20.530 1.00 102.68 ? 56 GLN A OE1 1 ATOM 431 N NE2 . GLN A 1 56 ? 24.385 95.141 21.137 1.00 112.98 ? 56 GLN A NE2 1 ATOM 432 N N . VAL A 1 57 ? 18.199 93.988 18.287 1.00 56.39 ? 57 VAL A N 1 ATOM 433 C CA . VAL A 1 57 ? 17.604 94.045 16.957 1.00 55.13 ? 57 VAL A CA 1 ATOM 434 C C . VAL A 1 57 ? 16.425 95.005 16.968 1.00 62.53 ? 57 VAL A C 1 ATOM 435 O O . VAL A 1 57 ? 15.521 94.888 17.796 1.00 62.14 ? 57 VAL A O 1 ATOM 436 C CB . VAL A 1 57 ? 17.131 92.655 16.488 1.00 59.14 ? 57 VAL A CB 1 ATOM 437 C CG1 . VAL A 1 57 ? 16.435 92.766 15.134 1.00 49.75 ? 57 VAL A CG1 1 ATOM 438 C CG2 . VAL A 1 57 ? 18.322 91.713 16.391 1.00 52.25 ? 57 VAL A CG2 1 ATOM 439 N N . GLU A 1 58 ? 16.439 95.959 16.045 1.00 61.39 ? 58 GLU A N 1 ATOM 440 C CA . GLU A 1 58 ? 15.376 96.950 15.983 1.00 59.46 ? 58 GLU A CA 1 ATOM 441 C C . GLU A 1 58 ? 14.459 96.819 14.771 1.00 52.47 ? 58 GLU A C 1 ATOM 442 O O . GLU A 1 58 ? 14.895 96.445 13.674 1.00 51.03 ? 58 GLU A O 1 ATOM 443 C CB . GLU A 1 58 ? 15.986 98.352 16.036 1.00 107.26 ? 58 GLU A CB 1 ATOM 444 C CG . GLU A 1 58 ? 16.738 98.619 17.333 1.00 124.82 ? 58 GLU A CG 1 ATOM 445 C CD . GLU A 1 58 ? 17.377 99.992 17.380 1.00 136.32 ? 58 GLU A CD 1 ATOM 446 O OE1 . GLU A 1 58 ? 16.644 100.998 17.271 1.00 145.44 ? 58 GLU A OE1 1 ATOM 447 O OE2 . GLU A 1 58 ? 18.614 100.062 17.530 1.00 136.84 ? 58 GLU A OE2 1 ATOM 448 N N . GLY A 1 59 ? 13.177 97.112 14.996 1.00 49.55 ? 59 GLY A N 1 ATOM 449 C CA . GLY A 1 59 ? 12.187 97.055 13.936 1.00 59.65 ? 59 GLY A CA 1 ATOM 450 C C . GLY A 1 59 ? 11.692 95.686 13.517 1.00 61.31 ? 59 GLY A C 1 ATOM 451 O O . GLY A 1 59 ? 11.100 95.552 12.444 1.00 57.66 ? 59 GLY A O 1 ATOM 452 N N . MET A 1 60 ? 11.926 94.667 14.338 1.00 68.19 ? 60 MET A N 1 ATOM 453 C CA . MET A 1 60 ? 11.474 93.322 14.007 1.00 60.96 ? 60 MET A CA 1 ATOM 454 C C . MET A 1 60 ? 10.122 93.052 14.649 1.00 61.19 ? 60 MET A C 1 ATOM 455 O O . MET A 1 60 ? 9.316 92.277 14.127 1.00 56.31 ? 60 MET A O 1 ATOM 456 C CB . MET A 1 60 ? 12.466 92.279 14.503 1.00 62.42 ? 60 MET A CB 1 ATOM 457 C CG . MET A 1 60 ? 11.990 90.859 14.268 1.00 55.66 ? 60 MET A CG 1 ATOM 458 S SD . MET A 1 60 ? 12.834 89.609 15.265 1.00 51.78 ? 60 MET A SD 1 ATOM 459 C CE . MET A 1 60 ? 13.957 88.946 14.073 1.00 66.86 ? 60 MET A CE 1 ATOM 460 N N . GLU A 1 61 ? 9.873 93.699 15.783 1.00 43.96 ? 61 GLU A N 1 ATOM 461 C CA . GLU A 1 61 ? 8.619 93.505 16.492 1.00 41.63 ? 61 GLU A CA 1 ATOM 462 C C . GLU A 1 61 ? 8.318 94.681 17.417 1.00 46.40 ? 61 GLU A C 1 ATOM 463 O O . GLU A 1 61 ? 9.219 95.233 18.050 1.00 51.40 ? 61 GLU A O 1 ATOM 464 C CB . GLU A 1 61 ? 8.696 92.202 17.304 1.00 50.83 ? 61 GLU A CB 1 ATOM 465 C CG . GLU A 1 61 ? 7.369 91.718 17.854 1.00 51.38 ? 61 GLU A CG 1 ATOM 466 C CD . GLU A 1 61 ? 6.370 91.431 16.754 1.00 54.67 ? 61 GLU A CD 1 ATOM 467 O OE1 . GLU A 1 61 ? 6.505 90.393 16.072 1.00 50.97 ? 61 GLU A OE1 1 ATOM 468 O OE2 . GLU A 1 61 ? 5.453 92.256 16.562 1.00 64.50 ? 61 GLU A OE2 1 ATOM 469 N N . ASP A 1 62 ? 7.048 95.068 17.490 1.00 53.47 ? 62 ASP A N 1 ATOM 470 C CA . ASP A 1 62 ? 6.638 96.163 18.362 1.00 56.79 ? 62 ASP A CA 1 ATOM 471 C C . ASP A 1 62 ? 6.314 95.507 19.698 1.00 56.38 ? 62 ASP A C 1 ATOM 472 O O . ASP A 1 62 ? 5.173 95.131 19.960 1.00 50.66 ? 62 ASP A O 1 ATOM 473 C CB . ASP A 1 62 ? 5.396 96.864 17.798 1.00 64.79 ? 62 ASP A CB 1 ATOM 474 C CG . ASP A 1 62 ? 5.062 98.152 18.538 1.00 68.49 ? 62 ASP A CG 1 ATOM 475 O OD1 . ASP A 1 62 ? 4.980 98.127 19.784 1.00 63.43 ? 62 ASP A OD1 1 ATOM 476 O OD2 . ASP A 1 62 ? 4.873 99.191 17.871 1.00 75.59 ? 62 ASP A OD2 1 ATOM 477 N N . TRP A 1 63 ? 7.329 95.357 20.538 1.00 50.06 ? 63 TRP A N 1 ATOM 478 C CA . TRP A 1 63 ? 7.146 94.715 21.830 1.00 47.23 ? 63 TRP A CA 1 ATOM 479 C C . TRP A 1 63 ? 6.002 95.276 22.653 1.00 48.83 ? 63 TRP A C 1 ATOM 480 O O . TRP A 1 63 ? 5.300 94.523 23.334 1.00 44.91 ? 63 TRP A O 1 ATOM 481 C CB . TRP A 1 63 ? 8.458 94.748 22.621 1.00 41.90 ? 63 TRP A CB 1 ATOM 482 C CG . TRP A 1 63 ? 9.500 93.919 21.950 1.00 39.16 ? 63 TRP A CG 1 ATOM 483 C CD1 . TRP A 1 63 ? 10.713 94.340 21.480 1.00 40.57 ? 63 TRP A CD1 1 ATOM 484 C CD2 . TRP A 1 63 ? 9.385 92.536 21.581 1.00 39.71 ? 63 TRP A CD2 1 ATOM 485 N NE1 . TRP A 1 63 ? 11.357 93.308 20.834 1.00 41.29 ? 63 TRP A NE1 1 ATOM 486 C CE2 . TRP A 1 63 ? 10.563 92.191 20.880 1.00 40.49 ? 63 TRP A CE2 1 ATOM 487 C CE3 . TRP A 1 63 ? 8.399 91.557 21.772 1.00 43.11 ? 63 TRP A CE3 1 ATOM 488 C CZ2 . TRP A 1 63 ? 10.782 90.905 20.368 1.00 44.62 ? 63 TRP A CZ2 1 ATOM 489 C CZ3 . TRP A 1 63 ? 8.618 90.278 21.263 1.00 41.03 ? 63 TRP A CZ3 1 ATOM 490 C CH2 . TRP A 1 63 ? 9.802 89.966 20.569 1.00 43.21 ? 63 TRP A CH2 1 ATOM 491 N N . LYS A 1 64 ? 5.796 96.584 22.591 1.00 59.05 ? 64 LYS A N 1 ATOM 492 C CA . LYS A 1 64 ? 4.716 97.182 23.360 1.00 61.21 ? 64 LYS A CA 1 ATOM 493 C C . LYS A 1 64 ? 3.392 96.592 22.907 1.00 56.69 ? 64 LYS A C 1 ATOM 494 O O . LYS A 1 64 ? 2.509 96.294 23.722 1.00 56.19 ? 64 LYS A O 1 ATOM 495 C CB . LYS A 1 64 ? 4.717 98.704 23.191 1.00 76.60 ? 64 LYS A CB 1 ATOM 496 C CG . LYS A 1 64 ? 5.947 99.361 23.810 1.00 92.36 ? 64 LYS A CG 1 ATOM 497 C CD . LYS A 1 64 ? 5.866 100.880 23.805 1.00 105.36 ? 64 LYS A CD 1 ATOM 498 C CE . LYS A 1 64 ? 7.017 101.499 24.598 1.00 109.51 ? 64 LYS A CE 1 ATOM 499 N NZ . LYS A 1 64 ? 8.354 101.126 24.058 1.00 116.33 ? 64 LYS A NZ 1 ATOM 500 N N . GLN A 1 65 ? 3.261 96.395 21.604 1.00 65.30 ? 65 GLN A N 1 ATOM 501 C CA . GLN A 1 65 ? 2.030 95.843 21.087 1.00 67.89 ? 65 GLN A CA 1 ATOM 502 C C . GLN A 1 65 ? 1.944 94.358 21.404 1.00 63.09 ? 65 GLN A C 1 ATOM 503 O O . GLN A 1 65 ? 0.913 93.876 21.875 1.00 62.66 ? 65 GLN A O 1 ATOM 504 C CB . GLN A 1 65 ? 1.927 96.074 19.581 1.00 72.21 ? 65 GLN A CB 1 ATOM 505 C CG . GLN A 1 65 ? 0.512 95.890 19.047 1.00 80.85 ? 65 GLN A CG 1 ATOM 506 C CD . GLN A 1 65 ? -0.533 96.632 19.882 1.00 92.24 ? 65 GLN A CD 1 ATOM 507 O OE1 . GLN A 1 65 ? -0.346 97.803 20.238 1.00 94.09 ? 65 GLN A OE1 1 ATOM 508 N NE2 . GLN A 1 65 ? -1.642 95.955 20.190 1.00 78.78 ? 65 GLN A NE2 1 ATOM 509 N N . ASP A 1 66 ? 3.030 93.632 21.162 1.00 48.45 ? 66 ASP A N 1 ATOM 510 C CA . ASP A 1 66 ? 3.039 92.203 21.435 1.00 47.08 ? 66 ASP A CA 1 ATOM 511 C C . ASP A 1 66 ? 2.683 91.907 22.889 1.00 48.68 ? 66 ASP A C 1 ATOM 512 O O . ASP A 1 66 ? 2.304 90.786 23.223 1.00 44.53 ? 66 ASP A O 1 ATOM 513 C CB . ASP A 1 66 ? 4.405 91.592 21.119 1.00 61.98 ? 66 ASP A CB 1 ATOM 514 C CG . ASP A 1 66 ? 4.401 90.078 21.244 1.00 70.78 ? 66 ASP A CG 1 ATOM 515 O OD1 . ASP A 1 66 ? 3.728 89.420 20.421 1.00 69.45 ? 66 ASP A OD1 1 ATOM 516 O OD2 . ASP A 1 66 ? 5.057 89.547 22.168 1.00 64.26 ? 66 ASP A OD2 1 ATOM 517 N N . SER A 1 67 ? 2.813 92.907 23.752 1.00 41.99 ? 67 SER A N 1 ATOM 518 C CA . SER A 1 67 ? 2.483 92.714 25.157 1.00 41.99 ? 67 SER A CA 1 ATOM 519 C C . SER A 1 67 ? 0.965 92.672 25.309 1.00 43.01 ? 67 SER A C 1 ATOM 520 O O . SER A 1 67 ? 0.432 91.915 26.122 1.00 41.99 ? 67 SER A O 1 ATOM 521 C CB . SER A 1 67 ? 3.065 93.844 26.005 1.00 51.81 ? 67 SER A CB 1 ATOM 522 O OG . SER A 1 67 ? 4.471 93.916 25.840 1.00 52.22 ? 67 SER A OG 1 ATOM 523 N N . GLN A 1 68 ? 0.272 93.484 24.515 1.00 42.30 ? 68 GLN A N 1 ATOM 524 C CA . GLN A 1 68 ? -1.181 93.516 24.559 1.00 40.39 ? 68 GLN A CA 1 ATOM 525 C C . GLN A 1 68 ? -1.672 92.174 24.064 1.00 40.39 ? 68 GLN A C 1 ATOM 526 O O . GLN A 1 68 ? -2.681 91.650 24.545 1.00 40.39 ? 68 GLN A O 1 ATOM 527 C CB . GLN A 1 68 ? -1.727 94.633 23.661 1.00 49.31 ? 68 GLN A CB 1 ATOM 528 C CG . GLN A 1 68 ? -1.281 96.026 24.064 1.00 50.52 ? 68 GLN A CG 1 ATOM 529 C CD . GLN A 1 68 ? -1.309 96.227 25.569 1.00 49.48 ? 68 GLN A CD 1 ATOM 530 O OE1 . GLN A 1 68 ? -2.358 96.101 26.210 1.00 59.63 ? 68 GLN A OE1 1 ATOM 531 N NE2 . GLN A 1 68 ? -0.150 96.535 26.142 1.00 49.12 ? 68 GLN A NE2 1 ATOM 532 N N . LEU A 1 69 ? -0.936 91.624 23.101 1.00 45.73 ? 69 LEU A N 1 ATOM 533 C CA . LEU A 1 69 ? -1.259 90.335 22.518 1.00 47.33 ? 69 LEU A CA 1 ATOM 534 C C . LEU A 1 69 ? -1.087 89.209 23.548 1.00 45.73 ? 69 LEU A C 1 ATOM 535 O O . LEU A 1 69 ? -1.965 88.347 23.686 1.00 45.73 ? 69 LEU A O 1 ATOM 536 C CB . LEU A 1 69 ? -0.368 90.076 21.301 1.00 35.51 ? 69 LEU A CB 1 ATOM 537 C CG . LEU A 1 69 ? -0.616 88.737 20.584 1.00 38.36 ? 69 LEU A CG 1 ATOM 538 C CD1 . LEU A 1 69 ? -1.996 88.736 19.945 1.00 36.05 ? 69 LEU A CD1 1 ATOM 539 C CD2 . LEU A 1 69 ? 0.459 88.497 19.539 1.00 37.81 ? 69 LEU A CD2 1 ATOM 540 N N . GLN A 1 70 ? 0.038 89.219 24.268 1.00 38.29 ? 70 GLN A N 1 ATOM 541 C CA . GLN A 1 70 ? 0.302 88.203 25.286 1.00 39.28 ? 70 GLN A CA 1 ATOM 542 C C . GLN A 1 70 ? -0.720 88.299 26.403 1.00 38.29 ? 70 GLN A C 1 ATOM 543 O O . GLN A 1 70 ? -1.141 87.287 26.950 1.00 38.65 ? 70 GLN A O 1 ATOM 544 C CB . GLN A 1 70 ? 1.694 88.357 25.894 1.00 39.01 ? 70 GLN A CB 1 ATOM 545 C CG . GLN A 1 70 ? 2.844 88.170 24.931 1.00 39.01 ? 70 GLN A CG 1 ATOM 546 C CD . GLN A 1 70 ? 2.706 86.941 24.059 1.00 39.01 ? 70 GLN A CD 1 ATOM 547 O OE1 . GLN A 1 70 ? 2.220 85.897 24.500 1.00 39.01 ? 70 GLN A OE1 1 ATOM 548 N NE2 . GLN A 1 70 ? 3.154 87.053 22.809 1.00 39.01 ? 70 GLN A NE2 1 ATOM 549 N N . LYS A 1 71 ? -1.112 89.514 26.760 1.00 36.60 ? 71 LYS A N 1 ATOM 550 C CA . LYS A 1 71 ? -2.103 89.675 27.820 1.00 34.30 ? 71 LYS A CA 1 ATOM 551 C C . LYS A 1 71 ? -3.423 89.022 27.384 1.00 34.30 ? 71 LYS A C 1 ATOM 552 O O . LYS A 1 71 ? -4.102 88.371 28.183 1.00 34.30 ? 71 LYS A O 1 ATOM 553 C CB . LYS A 1 71 ? -2.330 91.160 28.129 1.00 44.16 ? 71 LYS A CB 1 ATOM 554 C CG . LYS A 1 71 ? -1.115 91.874 28.683 1.00 52.99 ? 71 LYS A CG 1 ATOM 555 C CD . LYS A 1 71 ? -1.431 93.331 28.999 1.00 59.32 ? 71 LYS A CD 1 ATOM 556 C CE . LYS A 1 71 ? -0.165 94.134 29.277 1.00 63.48 ? 71 LYS A CE 1 ATOM 557 N NZ . LYS A 1 71 ? -0.438 95.593 29.445 1.00 61.04 ? 71 LYS A NZ 1 ATOM 558 N N . ALA A 1 72 ? -3.775 89.189 26.112 1.00 30.53 ? 72 ALA A N 1 ATOM 559 C CA . ALA A 1 72 ? -5.016 88.615 25.604 1.00 31.86 ? 72 ALA A CA 1 ATOM 560 C C . ALA A 1 72 ? -4.906 87.100 25.524 1.00 30.53 ? 72 ALA A C 1 ATOM 561 O O . ALA A 1 72 ? -5.882 86.399 25.767 1.00 30.53 ? 72 ALA A O 1 ATOM 562 C CB . ALA A 1 72 ? -5.344 89.185 24.225 1.00 28.15 ? 72 ALA A CB 1 ATOM 563 N N . ARG A 1 73 ? -3.720 86.606 25.162 1.00 32.50 ? 73 ARG A N 1 ATOM 564 C CA . ARG A 1 73 ? -3.484 85.167 25.062 1.00 32.54 ? 73 ARG A CA 1 ATOM 565 C C . ARG A 1 73 ? -3.610 84.578 26.460 1.00 32.50 ? 73 ARG A C 1 ATOM 566 O O . ARG A 1 73 ? -4.247 83.544 26.653 1.00 32.50 ? 73 ARG A O 1 ATOM 567 C CB . ARG A 1 73 ? -2.081 84.886 24.523 1.00 27.85 ? 73 ARG A CB 1 ATOM 568 C CG . ARG A 1 73 ? -1.856 85.277 23.055 1.00 32.70 ? 73 ARG A CG 1 ATOM 569 C CD . ARG A 1 73 ? -2.475 84.267 22.103 1.00 33.90 ? 73 ARG A CD 1 ATOM 570 N NE . ARG A 1 73 ? -2.256 84.608 20.698 1.00 35.34 ? 73 ARG A NE 1 ATOM 571 C CZ . ARG A 1 73 ? -1.069 84.609 20.088 1.00 32.91 ? 73 ARG A CZ 1 ATOM 572 N NH1 . ARG A 1 73 ? 0.032 84.287 20.761 1.00 31.27 ? 73 ARG A NH1 1 ATOM 573 N NH2 . ARG A 1 73 ? -0.981 84.926 18.798 1.00 27.85 ? 73 ARG A NH2 1 ATOM 574 N N . GLU A 1 74 ? -3.005 85.255 27.430 1.00 37.06 ? 74 GLU A N 1 ATOM 575 C CA . GLU A 1 74 ? -3.030 84.830 28.816 1.00 37.06 ? 74 GLU A CA 1 ATOM 576 C C . GLU A 1 74 ? -4.472 84.641 29.304 1.00 37.06 ? 74 GLU A C 1 ATOM 577 O O . GLU A 1 74 ? -4.816 83.604 29.884 1.00 37.06 ? 74 GLU A O 1 ATOM 578 C CB . GLU A 1 74 ? -2.316 85.875 29.677 1.00 41.76 ? 74 GLU A CB 1 ATOM 579 C CG . GLU A 1 74 ? -2.303 85.566 31.168 1.00 41.76 ? 74 GLU A CG 1 ATOM 580 C CD . GLU A 1 74 ? -1.800 86.732 32.021 1.00 43.90 ? 74 GLU A CD 1 ATOM 581 O OE1 . GLU A 1 74 ? -0.887 87.468 31.568 1.00 44.43 ? 74 GLU A OE1 1 ATOM 582 O OE2 . GLU A 1 74 ? -2.310 86.896 33.156 1.00 45.17 ? 74 GLU A OE2 1 ATOM 583 N N . ASP A 1 75 ? -5.320 85.637 29.064 1.00 37.65 ? 75 ASP A N 1 ATOM 584 C CA . ASP A 1 75 ? -6.709 85.557 29.500 1.00 37.65 ? 75 ASP A CA 1 ATOM 585 C C . ASP A 1 75 ? -7.377 84.285 29.003 1.00 37.65 ? 75 ASP A C 1 ATOM 586 O O . ASP A 1 75 ? -7.961 83.541 29.790 1.00 37.65 ? 75 ASP A O 1 ATOM 587 C CB . ASP A 1 75 ? -7.500 86.773 29.019 1.00 63.76 ? 75 ASP A CB 1 ATOM 588 C CG . ASP A 1 75 ? -6.935 88.077 29.540 1.00 77.42 ? 75 ASP A CG 1 ATOM 589 O OD1 . ASP A 1 75 ? -6.648 88.162 30.755 1.00 76.46 ? 75 ASP A OD1 1 ATOM 590 O OD2 . ASP A 1 75 ? -6.787 89.020 28.733 1.00 77.51 ? 75 ASP A OD2 1 ATOM 591 N N . ILE A 1 76 ? -7.294 84.025 27.703 1.00 33.23 ? 76 ILE A N 1 ATOM 592 C CA . ILE A 1 76 ? -7.906 82.823 27.156 1.00 33.23 ? 76 ILE A CA 1 ATOM 593 C C . ILE A 1 76 ? -7.259 81.554 27.745 1.00 33.23 ? 76 ILE A C 1 ATOM 594 O O . ILE A 1 76 ? -7.948 80.623 28.171 1.00 33.23 ? 76 ILE A O 1 ATOM 595 C CB . ILE A 1 76 ? -7.792 82.798 25.616 1.00 39.34 ? 76 ILE A CB 1 ATOM 596 C CG1 . ILE A 1 76 ? -8.496 84.020 25.034 1.00 45.24 ? 76 ILE A CG1 1 ATOM 597 C CG2 . ILE A 1 76 ? -8.431 81.534 25.058 1.00 40.55 ? 76 ILE A CG2 1 ATOM 598 C CD1 . ILE A 1 76 ? -8.227 84.231 23.548 1.00 58.39 ? 76 ILE A CD1 1 ATOM 599 N N . PHE A 1 77 ? -5.934 81.533 27.782 1.00 31.15 ? 77 PHE A N 1 ATOM 600 C CA . PHE A 1 77 ? -5.208 80.388 28.312 1.00 31.15 ? 77 PHE A CA 1 ATOM 601 C C . PHE A 1 77 ? -5.658 80.064 29.738 1.00 31.15 ? 77 PHE A C 1 ATOM 602 O O . PHE A 1 77 ? -6.138 78.961 30.002 1.00 31.15 ? 77 PHE A O 1 ATOM 603 C CB . PHE A 1 77 ? -3.705 80.668 28.292 1.00 31.76 ? 77 PHE A CB 1 ATOM 604 C CG . PHE A 1 77 ? -2.857 79.436 28.408 1.00 31.76 ? 77 PHE A CG 1 ATOM 605 C CD1 . PHE A 1 77 ? -2.605 78.646 27.287 1.00 31.76 ? 77 PHE A CD1 1 ATOM 606 C CD2 . PHE A 1 77 ? -2.309 79.065 29.639 1.00 31.76 ? 77 PHE A CD2 1 ATOM 607 C CE1 . PHE A 1 77 ? -1.811 77.492 27.387 1.00 31.76 ? 77 PHE A CE1 1 ATOM 608 C CE2 . PHE A 1 77 ? -1.518 77.923 29.757 1.00 31.76 ? 77 PHE A CE2 1 ATOM 609 C CZ . PHE A 1 77 ? -1.264 77.127 28.628 1.00 31.76 ? 77 PHE A CZ 1 ATOM 610 N N . MET A 1 78 ? -5.521 81.027 30.647 1.00 32.62 ? 78 MET A N 1 ATOM 611 C CA . MET A 1 78 ? -5.912 80.811 32.039 1.00 32.62 ? 78 MET A CA 1 ATOM 612 C C . MET A 1 78 ? -7.401 80.500 32.225 1.00 32.62 ? 78 MET A C 1 ATOM 613 O O . MET A 1 78 ? -7.780 79.861 33.206 1.00 32.62 ? 78 MET A O 1 ATOM 614 C CB . MET A 1 78 ? -5.518 82.011 32.912 1.00 34.45 ? 78 MET A CB 1 ATOM 615 C CG . MET A 1 78 ? -4.003 82.304 32.959 1.00 34.45 ? 78 MET A CG 1 ATOM 616 S SD . MET A 1 78 ? -2.922 80.874 33.295 1.00 34.45 ? 78 MET A SD 1 ATOM 617 C CE . MET A 1 78 ? -3.058 80.738 35.110 1.00 34.45 ? 78 MET A CE 1 ATOM 618 N N . GLU A 1 79 ? -8.250 80.946 31.303 1.00 35.78 ? 79 GLU A N 1 ATOM 619 C CA . GLU A 1 79 ? -9.668 80.631 31.424 1.00 35.78 ? 79 GLU A CA 1 ATOM 620 C C . GLU A 1 79 ? -9.795 79.140 31.105 1.00 35.78 ? 79 GLU A C 1 ATOM 621 O O . GLU A 1 79 ? -10.565 78.415 31.747 1.00 35.78 ? 79 GLU A O 1 ATOM 622 C CB . GLU A 1 79 ? -10.509 81.432 30.434 1.00 70.02 ? 79 GLU A CB 1 ATOM 623 C CG . GLU A 1 79 ? -11.976 81.497 30.840 1.00 83.14 ? 79 GLU A CG 1 ATOM 624 C CD . GLU A 1 79 ? -12.884 82.049 29.752 1.00 92.52 ? 79 GLU A CD 1 ATOM 625 O OE1 . GLU A 1 79 ? -12.498 83.037 29.085 1.00 89.01 ? 79 GLU A OE1 1 ATOM 626 O OE2 . GLU A 1 79 ? -13.994 81.500 29.574 1.00 94.76 ? 79 GLU A OE2 1 ATOM 627 N N . THR A 1 80 ? -9.022 78.693 30.110 1.00 24.99 ? 80 THR A N 1 ATOM 628 C CA . THR A 1 80 ? -9.015 77.301 29.701 1.00 24.99 ? 80 THR A CA 1 ATOM 629 C C . THR A 1 80 ? -8.619 76.459 30.909 1.00 24.99 ? 80 THR A C 1 ATOM 630 O O . THR A 1 80 ? -9.338 75.526 31.281 1.00 24.99 ? 80 THR A O 1 ATOM 631 C CB . THR A 1 80 ? -7.997 77.054 28.558 1.00 26.27 ? 80 THR A CB 1 ATOM 632 O OG1 . THR A 1 80 ? -8.327 77.878 27.435 1.00 26.27 ? 80 THR A OG1 1 ATOM 633 C CG2 . THR A 1 80 ? -8.008 75.587 28.124 1.00 26.27 ? 80 THR A CG2 1 ATOM 634 N N . LEU A 1 81 ? -7.476 76.783 31.518 1.00 27.58 ? 81 LEU A N 1 ATOM 635 C CA . LEU A 1 81 ? -7.022 76.047 32.692 1.00 27.58 ? 81 LEU A CA 1 ATOM 636 C C . LEU A 1 81 ? -8.134 76.075 33.733 1.00 27.58 ? 81 LEU A C 1 ATOM 637 O O . LEU A 1 81 ? -8.470 75.049 34.319 1.00 27.58 ? 81 LEU A O 1 ATOM 638 C CB . LEU A 1 81 ? -5.735 76.660 33.267 1.00 20.11 ? 81 LEU A CB 1 ATOM 639 C CG . LEU A 1 81 ? -5.202 76.139 34.615 1.00 20.11 ? 81 LEU A CG 1 ATOM 640 C CD1 . LEU A 1 81 ? -5.057 74.626 34.597 1.00 20.11 ? 81 LEU A CD1 1 ATOM 641 C CD2 . LEU A 1 81 ? -3.854 76.780 34.897 1.00 20.11 ? 81 LEU A CD2 1 ATOM 642 N N . LYS A 1 82 ? -8.727 77.245 33.932 1.00 30.49 ? 82 LYS A N 1 ATOM 643 C CA . LYS A 1 82 ? -9.814 77.392 34.897 1.00 30.49 ? 82 LYS A CA 1 ATOM 644 C C . LYS A 1 82 ? -10.954 76.397 34.636 1.00 30.49 ? 82 LYS A C 1 ATOM 645 O O . LYS A 1 82 ? -11.402 75.701 35.556 1.00 30.49 ? 82 LYS A O 1 ATOM 646 C CB . LYS A 1 82 ? -10.364 78.823 34.869 1.00 57.90 ? 82 LYS A CB 1 ATOM 647 C CG . LYS A 1 82 ? -11.247 79.162 36.066 1.00 70.54 ? 82 LYS A CG 1 ATOM 648 C CD . LYS A 1 82 ? -11.790 80.593 36.017 1.00 80.73 ? 82 LYS A CD 1 ATOM 649 C CE . LYS A 1 82 ? -13.156 80.678 35.334 1.00 86.90 ? 82 LYS A CE 1 ATOM 650 N NZ . LYS A 1 82 ? -13.141 80.257 33.906 1.00 90.85 ? 82 LYS A NZ 1 ATOM 651 N N . ASP A 1 83 ? -11.404 76.316 33.384 1.00 32.92 ? 83 ASP A N 1 ATOM 652 C CA . ASP A 1 83 ? -12.496 75.413 33.027 1.00 32.92 ? 83 ASP A CA 1 ATOM 653 C C . ASP A 1 83 ? -12.176 73.929 33.262 1.00 32.92 ? 83 ASP A C 1 ATOM 654 O O . ASP A 1 83 ? -13.058 73.141 33.631 1.00 32.92 ? 83 ASP A O 1 ATOM 655 C CB . ASP A 1 83 ? -12.910 75.622 31.567 1.00 43.21 ? 83 ASP A CB 1 ATOM 656 C CG . ASP A 1 83 ? -13.422 77.036 31.294 1.00 57.17 ? 83 ASP A CG 1 ATOM 657 O OD1 . ASP A 1 83 ? -14.144 77.598 32.146 1.00 56.08 ? 83 ASP A OD1 1 ATOM 658 O OD2 . ASP A 1 83 ? -13.117 77.586 30.213 1.00 58.66 ? 83 ASP A OD2 1 ATOM 659 N N . ILE A 1 84 ? -10.924 73.541 33.052 1.00 28.79 ? 84 ILE A N 1 ATOM 660 C CA . ILE A 1 84 ? -10.549 72.150 33.249 1.00 28.79 ? 84 ILE A CA 1 ATOM 661 C C . ILE A 1 84 ? -10.655 71.797 34.738 1.00 28.79 ? 84 ILE A C 1 ATOM 662 O O . ILE A 1 84 ? -11.176 70.733 35.102 1.00 28.79 ? 84 ILE A O 1 ATOM 663 C CB . ILE A 1 84 ? -9.107 71.889 32.729 1.00 17.00 ? 84 ILE A CB 1 ATOM 664 C CG1 . ILE A 1 84 ? -9.046 72.243 31.234 1.00 17.00 ? 84 ILE A CG1 1 ATOM 665 C CG2 . ILE A 1 84 ? -8.683 70.440 33.018 1.00 17.00 ? 84 ILE A CG2 1 ATOM 666 C CD1 . ILE A 1 84 ? -7.680 72.073 30.594 1.00 17.00 ? 84 ILE A CD1 1 ATOM 667 N N . VAL A 1 85 ? -10.178 72.693 35.598 1.00 36.42 ? 85 VAL A N 1 ATOM 668 C CA . VAL A 1 85 ? -10.254 72.439 37.030 1.00 36.42 ? 85 VAL A CA 1 ATOM 669 C C . VAL A 1 85 ? -11.717 72.413 37.475 1.00 36.42 ? 85 VAL A C 1 ATOM 670 O O . VAL A 1 85 ? -12.117 71.582 38.286 1.00 36.53 ? 85 VAL A O 1 ATOM 671 C CB . VAL A 1 85 ? -9.487 73.506 37.832 1.00 31.16 ? 85 VAL A CB 1 ATOM 672 C CG1 . VAL A 1 85 ? -9.853 73.406 39.290 1.00 34.43 ? 85 VAL A CG1 1 ATOM 673 C CG2 . VAL A 1 85 ? -7.983 73.302 37.662 1.00 30.99 ? 85 VAL A CG2 1 ATOM 674 N N . GLU A 1 86 ? -12.512 73.329 36.938 1.00 39.00 ? 86 GLU A N 1 ATOM 675 C CA . GLU A 1 86 ? -13.931 73.394 37.261 1.00 43.90 ? 86 GLU A CA 1 ATOM 676 C C . GLU A 1 86 ? -14.550 72.053 36.894 1.00 45.20 ? 86 GLU A C 1 ATOM 677 O O . GLU A 1 86 ? -15.464 71.576 37.554 1.00 41.87 ? 86 GLU A O 1 ATOM 678 C CB . GLU A 1 86 ? -14.623 74.491 36.439 1.00 67.03 ? 86 GLU A CB 1 ATOM 679 C CG . GLU A 1 86 ? -15.255 75.618 37.244 1.00 91.31 ? 86 GLU A CG 1 ATOM 680 C CD . GLU A 1 86 ? -14.245 76.657 37.707 1.00 102.30 ? 86 GLU A CD 1 ATOM 681 O OE1 . GLU A 1 86 ? -13.317 76.300 38.467 1.00 110.97 ? 86 GLU A OE1 1 ATOM 682 O OE2 . GLU A 1 86 ? -14.380 77.834 37.307 1.00 97.30 ? 86 GLU A OE2 1 ATOM 683 N N . TYR A 1 87 ? -14.050 71.440 35.831 1.00 36.87 ? 87 TYR A N 1 ATOM 684 C CA . TYR A 1 87 ? -14.610 70.173 35.395 1.00 36.83 ? 87 TYR A CA 1 ATOM 685 C C . TYR A 1 87 ? -14.265 69.016 36.340 1.00 36.83 ? 87 TYR A C 1 ATOM 686 O O . TYR A 1 87 ? -15.097 68.141 36.605 1.00 36.83 ? 87 TYR A O 1 ATOM 687 C CB . TYR A 1 87 ? -14.142 69.852 33.966 1.00 29.54 ? 87 TYR A CB 1 ATOM 688 C CG . TYR A 1 87 ? -14.607 68.499 33.483 1.00 29.54 ? 87 TYR A CG 1 ATOM 689 C CD1 . TYR A 1 87 ? -15.886 68.324 32.964 1.00 29.54 ? 87 TYR A CD1 1 ATOM 690 C CD2 . TYR A 1 87 ? -13.787 67.376 33.614 1.00 29.54 ? 87 TYR A CD2 1 ATOM 691 C CE1 . TYR A 1 87 ? -16.346 67.052 32.587 1.00 34.88 ? 87 TYR A CE1 1 ATOM 692 C CE2 . TYR A 1 87 ? -14.230 66.108 33.246 1.00 31.83 ? 87 TYR A CE2 1 ATOM 693 C CZ . TYR A 1 87 ? -15.514 65.948 32.736 1.00 29.83 ? 87 TYR A CZ 1 ATOM 694 O OH . TYR A 1 87 ? -15.976 64.677 32.432 1.00 31.81 ? 87 TYR A OH 1 ATOM 695 N N . TYR A 1 88 ? -13.037 69.003 36.838 1.00 40.31 ? 88 TYR A N 1 ATOM 696 C CA . TYR A 1 88 ? -12.628 67.947 37.738 1.00 40.31 ? 88 TYR A CA 1 ATOM 697 C C . TYR A 1 88 ? -12.979 68.271 39.186 1.00 42.91 ? 88 TYR A C 1 ATOM 698 O O . TYR A 1 88 ? -12.640 67.514 40.105 1.00 40.66 ? 88 TYR A O 1 ATOM 699 C CB . TYR A 1 88 ? -11.135 67.676 37.571 1.00 34.42 ? 88 TYR A CB 1 ATOM 700 C CG . TYR A 1 88 ? -10.859 66.926 36.299 1.00 34.42 ? 88 TYR A CG 1 ATOM 701 C CD1 . TYR A 1 88 ? -10.450 67.592 35.138 1.00 34.42 ? 88 TYR A CD1 1 ATOM 702 C CD2 . TYR A 1 88 ? -11.101 65.550 36.224 1.00 34.42 ? 88 TYR A CD2 1 ATOM 703 C CE1 . TYR A 1 88 ? -10.294 66.905 33.934 1.00 34.42 ? 88 TYR A CE1 1 ATOM 704 C CE2 . TYR A 1 88 ? -10.954 64.859 35.036 1.00 36.85 ? 88 TYR A CE2 1 ATOM 705 C CZ . TYR A 1 88 ? -10.554 65.537 33.895 1.00 34.42 ? 88 TYR A CZ 1 ATOM 706 O OH . TYR A 1 88 ? -10.447 64.844 32.713 1.00 34.42 ? 88 TYR A OH 1 ATOM 707 N N . LYS A 1 89 ? -13.677 69.391 39.373 1.00 53.55 ? 89 LYS A N 1 ATOM 708 C CA . LYS A 1 89 ? -14.105 69.829 40.694 1.00 63.42 ? 89 LYS A CA 1 ATOM 709 C C . LYS A 1 89 ? -12.962 69.749 41.696 1.00 63.06 ? 89 LYS A C 1 ATOM 710 O O . LYS A 1 89 ? -13.131 69.229 42.800 1.00 63.05 ? 89 LYS A O 1 ATOM 711 C CB . LYS A 1 89 ? -15.266 68.960 41.176 1.00 59.30 ? 89 LYS A CB 1 ATOM 712 C CG . LYS A 1 89 ? -16.500 69.032 40.299 1.00 66.36 ? 89 LYS A CG 1 ATOM 713 C CD . LYS A 1 89 ? -17.587 68.103 40.813 1.00 76.09 ? 89 LYS A CD 1 ATOM 714 C CE . LYS A 1 89 ? -18.818 68.146 39.923 1.00 77.42 ? 89 LYS A CE 1 ATOM 715 N NZ . LYS A 1 89 ? -19.897 67.249 40.423 1.00 86.33 ? 89 LYS A NZ 1 ATOM 716 N N . ASP A 1 90 ? -11.800 70.267 41.310 1.00 59.19 ? 90 ASP A N 1 ATOM 717 C CA . ASP A 1 90 ? -10.640 70.230 42.185 1.00 58.56 ? 90 ASP A CA 1 ATOM 718 C C . ASP A 1 90 ? -9.875 71.553 42.194 1.00 60.21 ? 90 ASP A C 1 ATOM 719 O O . ASP A 1 90 ? -8.674 71.597 41.913 1.00 56.88 ? 90 ASP A O 1 ATOM 720 C CB . ASP A 1 90 ? -9.720 69.082 41.764 1.00 69.51 ? 90 ASP A CB 1 ATOM 721 C CG . ASP A 1 90 ? -8.548 68.910 42.697 1.00 79.64 ? 90 ASP A CG 1 ATOM 722 O OD1 . ASP A 1 90 ? -8.742 69.073 43.919 1.00 86.83 ? 90 ASP A OD1 1 ATOM 723 O OD2 . ASP A 1 90 ? -7.438 68.603 42.216 1.00 77.09 ? 90 ASP A OD2 1 ATOM 724 N N . SER A 1 91 ? -10.581 72.632 42.528 1.00 55.24 ? 91 SER A N 1 ATOM 725 C CA . SER A 1 91 ? -9.973 73.961 42.577 1.00 63.49 ? 91 SER A CA 1 ATOM 726 C C . SER A 1 91 ? -9.031 74.144 43.769 1.00 63.23 ? 91 SER A C 1 ATOM 727 O O . SER A 1 91 ? -8.308 75.132 43.849 1.00 65.41 ? 91 SER A O 1 ATOM 728 C CB . SER A 1 91 ? -11.063 75.033 42.610 1.00 62.08 ? 91 SER A CB 1 ATOM 729 O OG . SER A 1 91 ? -11.901 74.852 43.736 1.00 76.52 ? 91 SER A OG 1 ATOM 730 N N . THR A 1 92 ? -9.037 73.189 44.691 1.00 61.78 ? 92 THR A N 1 ATOM 731 C CA . THR A 1 92 ? -8.176 73.266 45.865 1.00 65.94 ? 92 THR A CA 1 ATOM 732 C C . THR A 1 92 ? -6.799 72.704 45.543 1.00 65.14 ? 92 THR A C 1 ATOM 733 O O . THR A 1 92 ? -5.843 72.923 46.288 1.00 62.75 ? 92 THR A O 1 ATOM 734 C CB . THR A 1 92 ? -8.753 72.457 47.046 1.00 86.34 ? 92 THR A CB 1 ATOM 735 O OG1 . THR A 1 92 ? -8.745 71.061 46.716 1.00 94.66 ? 92 THR A OG1 1 ATOM 736 C CG2 . THR A 1 92 ? -10.180 72.899 47.353 1.00 89.13 ? 92 THR A CG2 1 ATOM 737 N N . GLY A 1 93 ? -6.708 71.974 44.433 1.00 56.46 ? 93 GLY A N 1 ATOM 738 C CA . GLY A 1 93 ? -5.444 71.383 44.032 1.00 54.03 ? 93 GLY A CA 1 ATOM 739 C C . GLY A 1 93 ? -4.588 72.318 43.199 1.00 44.21 ? 93 GLY A C 1 ATOM 740 O O . GLY A 1 93 ? -5.029 73.401 42.813 1.00 42.11 ? 93 GLY A O 1 ATOM 741 N N . SER A 1 94 ? -3.360 71.896 42.920 1.00 59.52 ? 94 SER A N 1 ATOM 742 C CA . SER A 1 94 ? -2.437 72.698 42.123 1.00 56.90 ? 94 SER A CA 1 ATOM 743 C C . SER A 1 94 ? -2.286 72.062 40.732 1.00 49.09 ? 94 SER A C 1 ATOM 744 O O . SER A 1 94 ? -1.746 70.967 40.598 1.00 49.09 ? 94 SER A O 1 ATOM 745 C CB . SER A 1 94 ? -1.078 72.773 42.828 1.00 64.42 ? 94 SER A CB 1 ATOM 746 O OG . SER A 1 94 ? -0.304 73.849 42.334 1.00 71.63 ? 94 SER A OG 1 ATOM 747 N N . HIS A 1 95 ? -2.754 72.748 39.697 1.00 26.98 ? 95 HIS A N 1 ATOM 748 C CA . HIS A 1 95 ? -2.670 72.184 38.354 1.00 26.98 ? 95 HIS A CA 1 ATOM 749 C C . HIS A 1 95 ? -1.955 73.014 37.312 1.00 26.98 ? 95 HIS A C 1 ATOM 750 O O . HIS A 1 95 ? -1.858 74.238 37.405 1.00 26.98 ? 95 HIS A O 1 ATOM 751 C CB . HIS A 1 95 ? -4.068 71.857 37.848 1.00 37.54 ? 95 HIS A CB 1 ATOM 752 C CG . HIS A 1 95 ? -4.868 71.053 38.817 1.00 37.54 ? 95 HIS A CG 1 ATOM 753 N ND1 . HIS A 1 95 ? -4.633 69.711 39.040 1.00 37.54 ? 95 HIS A ND1 1 ATOM 754 C CD2 . HIS A 1 95 ? -5.864 71.412 39.661 1.00 37.54 ? 95 HIS A CD2 1 ATOM 755 C CE1 . HIS A 1 95 ? -5.453 69.279 39.983 1.00 37.54 ? 95 HIS A CE1 1 ATOM 756 N NE2 . HIS A 1 95 ? -6.209 70.291 40.376 1.00 37.54 ? 95 HIS A NE2 1 ATOM 757 N N . VAL A 1 96 ? -1.458 72.326 36.298 1.00 24.69 ? 96 VAL A N 1 ATOM 758 C CA . VAL A 1 96 ? -0.755 73.018 35.240 1.00 24.69 ? 96 VAL A CA 1 ATOM 759 C C . VAL A 1 96 ? -1.294 72.688 33.856 1.00 24.69 ? 96 VAL A C 1 ATOM 760 O O . VAL A 1 96 ? -1.766 71.567 33.590 1.00 24.69 ? 96 VAL A O 1 ATOM 761 C CB . VAL A 1 96 ? 0.760 72.713 35.280 1.00 13.18 ? 96 VAL A CB 1 ATOM 762 C CG1 . VAL A 1 96 ? 0.992 71.216 35.306 1.00 13.18 ? 96 VAL A CG1 1 ATOM 763 C CG2 . VAL A 1 96 ? 1.437 73.331 34.080 1.00 13.18 ? 96 VAL A CG2 1 ATOM 764 N N . LEU A 1 97 ? -1.248 73.707 32.998 1.00 21.88 ? 97 LEU A N 1 ATOM 765 C CA . LEU A 1 97 ? -1.652 73.586 31.606 1.00 21.88 ? 97 LEU A CA 1 ATOM 766 C C . LEU A 1 97 ? -0.468 74.138 30.824 1.00 21.88 ? 97 LEU A C 1 ATOM 767 O O . LEU A 1 97 ? -0.002 75.245 31.120 1.00 21.88 ? 97 LEU A O 1 ATOM 768 C CB . LEU A 1 97 ? -2.885 74.438 31.309 1.00 22.87 ? 97 LEU A CB 1 ATOM 769 C CG . LEU A 1 97 ? -3.303 74.458 29.830 1.00 22.87 ? 97 LEU A CG 1 ATOM 770 C CD1 . LEU A 1 97 ? -3.798 73.064 29.441 1.00 22.87 ? 97 LEU A CD1 1 ATOM 771 C CD2 . LEU A 1 97 ? -4.385 75.486 29.585 1.00 22.87 ? 97 LEU A CD2 1 ATOM 772 N N . GLN A 1 98 ? 0.038 73.365 29.859 1.00 25.31 ? 98 GLN A N 1 ATOM 773 C CA . GLN A 1 98 ? 1.156 73.825 29.030 1.00 25.31 ? 98 GLN A CA 1 ATOM 774 C C . GLN A 1 98 ? 0.775 73.785 27.562 1.00 25.31 ? 98 GLN A C 1 ATOM 775 O O . GLN A 1 98 ? 0.107 72.862 27.106 1.00 25.31 ? 98 GLN A O 1 ATOM 776 C CB . GLN A 1 98 ? 2.427 73.007 29.306 1.00 26.12 ? 98 GLN A CB 1 ATOM 777 C CG . GLN A 1 98 ? 2.961 73.281 30.718 1.00 26.12 ? 98 GLN A CG 1 ATOM 778 C CD . GLN A 1 98 ? 3.905 72.214 31.249 1.00 26.12 ? 98 GLN A CD 1 ATOM 779 O OE1 . GLN A 1 98 ? 5.111 72.433 31.346 1.00 26.12 ? 98 GLN A OE1 1 ATOM 780 N NE2 . GLN A 1 98 ? 3.357 71.055 31.598 1.00 26.12 ? 98 GLN A NE2 1 ATOM 781 N N . GLY A 1 99 ? 1.174 74.820 26.835 1.00 25.81 ? 99 GLY A N 1 ATOM 782 C CA . GLY A 1 99 ? 0.842 74.895 25.431 1.00 25.81 ? 99 GLY A CA 1 ATOM 783 C C . GLY A 1 99 ? 2.069 75.014 24.569 1.00 25.81 ? 99 GLY A C 1 ATOM 784 O O . GLY A 1 99 ? 3.067 75.633 24.955 1.00 25.81 ? 99 GLY A O 1 ATOM 785 N N . ARG A 1 100 ? 2.001 74.422 23.388 1.00 22.75 ? 100 ARG A N 1 ATOM 786 C CA . ARG A 1 100 ? 3.121 74.448 22.482 1.00 22.75 ? 100 ARG A CA 1 ATOM 787 C C . ARG A 1 100 ? 2.623 74.685 21.063 1.00 22.75 ? 100 ARG A C 1 ATOM 788 O O . ARG A 1 100 ? 1.689 74.020 20.597 1.00 22.75 ? 100 ARG A O 1 ATOM 789 C CB . ARG A 1 100 ? 3.867 73.121 22.578 1.00 29.21 ? 100 ARG A CB 1 ATOM 790 C CG . ARG A 1 100 ? 5.079 73.044 21.720 1.00 29.21 ? 100 ARG A CG 1 ATOM 791 C CD . ARG A 1 100 ? 5.942 71.840 22.053 1.00 29.21 ? 100 ARG A CD 1 ATOM 792 N NE . ARG A 1 100 ? 7.094 71.797 21.159 1.00 36.12 ? 100 ARG A NE 1 ATOM 793 C CZ . ARG A 1 100 ? 7.042 71.312 19.922 1.00 34.48 ? 100 ARG A CZ 1 ATOM 794 N NH1 . ARG A 1 100 ? 5.895 70.820 19.459 1.00 29.21 ? 100 ARG A NH1 1 ATOM 795 N NH2 . ARG A 1 100 ? 8.119 71.345 19.135 1.00 29.58 ? 100 ARG A NH2 1 ATOM 796 N N . PHE A 1 101 ? 3.227 75.646 20.376 1.00 33.85 ? 101 PHE A N 1 ATOM 797 C CA . PHE A 1 101 ? 2.823 75.912 19.013 1.00 33.85 ? 101 PHE A CA 1 ATOM 798 C C . PHE A 1 101 ? 3.872 76.666 18.233 1.00 33.85 ? 101 PHE A C 1 ATOM 799 O O . PHE A 1 101 ? 4.688 77.398 18.791 1.00 33.85 ? 101 PHE A O 1 ATOM 800 C CB . PHE A 1 101 ? 1.482 76.662 18.976 1.00 33.08 ? 101 PHE A CB 1 ATOM 801 C CG . PHE A 1 101 ? 1.483 77.973 19.705 1.00 33.08 ? 101 PHE A CG 1 ATOM 802 C CD1 . PHE A 1 101 ? 1.823 79.154 19.047 1.00 33.08 ? 101 PHE A CD1 1 ATOM 803 C CD2 . PHE A 1 101 ? 1.132 78.034 21.059 1.00 33.08 ? 101 PHE A CD2 1 ATOM 804 C CE1 . PHE A 1 101 ? 1.815 80.395 19.731 1.00 33.08 ? 101 PHE A CE1 1 ATOM 805 C CE2 . PHE A 1 101 ? 1.118 79.269 21.761 1.00 33.08 ? 101 PHE A CE2 1 ATOM 806 C CZ . PHE A 1 101 ? 1.463 80.450 21.091 1.00 34.24 ? 101 PHE A CZ 1 ATOM 807 N N . GLY A 1 102 ? 3.857 76.461 16.927 1.00 28.45 ? 102 GLY A N 1 ATOM 808 C CA . GLY A 1 102 ? 4.810 77.139 16.085 1.00 28.45 ? 102 GLY A CA 1 ATOM 809 C C . GLY A 1 102 ? 4.879 76.464 14.746 1.00 28.45 ? 102 GLY A C 1 ATOM 810 O O . GLY A 1 102 ? 3.996 75.681 14.393 1.00 28.45 ? 102 GLY A O 1 ATOM 811 N N . CYS A 1 103 ? 5.932 76.762 14.002 1.00 28.24 ? 103 CYS A N 1 ATOM 812 C CA . CYS A 1 103 ? 6.116 76.168 12.692 1.00 28.24 ? 103 CYS A CA 1 ATOM 813 C C . CYS A 1 103 ? 7.589 76.118 12.329 1.00 28.24 ? 103 CYS A C 1 ATOM 814 O O . CYS A 1 103 ? 8.468 76.528 13.108 1.00 28.24 ? 103 CYS A O 1 ATOM 815 C CB . CYS A 1 103 ? 5.360 76.975 11.642 1.00 44.86 ? 103 CYS A CB 1 ATOM 816 S SG . CYS A 1 103 ? 5.815 78.714 11.642 1.00 44.86 ? 103 CYS A SG 1 ATOM 817 N N . GLU A 1 104 ? 7.854 75.608 11.136 1.00 41.52 ? 104 GLU A N 1 ATOM 818 C CA . GLU A 1 104 ? 9.215 75.505 10.662 1.00 41.52 ? 104 GLU A CA 1 ATOM 819 C C . GLU A 1 104 ? 9.258 75.550 9.140 1.00 41.52 ? 104 GLU A C 1 ATOM 820 O O . GLU A 1 104 ? 8.362 75.055 8.457 1.00 41.52 ? 104 GLU A O 1 ATOM 821 C CB . GLU A 1 104 ? 9.837 74.208 11.173 1.00 27.56 ? 104 GLU A CB 1 ATOM 822 C CG . GLU A 1 104 ? 9.021 73.002 10.837 1.00 50.92 ? 104 GLU A CG 1 ATOM 823 C CD . GLU A 1 104 ? 9.747 71.723 11.138 1.00 65.34 ? 104 GLU A CD 1 ATOM 824 O OE1 . GLU A 1 104 ? 10.829 71.513 10.547 1.00 63.96 ? 104 GLU A OE1 1 ATOM 825 O OE2 . GLU A 1 104 ? 9.236 70.934 11.961 1.00 63.39 ? 104 GLU A OE2 1 ATOM 826 N N . ILE A 1 105 ? 10.301 76.166 8.611 1.00 40.06 ? 105 ILE A N 1 ATOM 827 C CA . ILE A 1 105 ? 10.454 76.254 7.173 1.00 40.06 ? 105 ILE A CA 1 ATOM 828 C C . ILE A 1 105 ? 11.782 75.628 6.809 1.00 41.74 ? 105 ILE A C 1 ATOM 829 O O . ILE A 1 105 ? 12.723 75.617 7.607 1.00 40.06 ? 105 ILE A O 1 ATOM 830 C CB . ILE A 1 105 ? 10.453 77.713 6.680 1.00 45.01 ? 105 ILE A CB 1 ATOM 831 C CG1 . ILE A 1 105 ? 11.534 78.490 7.416 1.00 53.85 ? 105 ILE A CG1 1 ATOM 832 C CG2 . ILE A 1 105 ? 9.087 78.356 6.899 1.00 41.71 ? 105 ILE A CG2 1 ATOM 833 C CD1 . ILE A 1 105 ? 11.512 79.963 7.112 1.00 58.49 ? 105 ILE A CD1 1 ATOM 834 N N . GLU A 1 106 ? 11.844 75.093 5.600 1.00 69.97 ? 106 GLU A N 1 ATOM 835 C CA . GLU A 1 106 ? 13.053 74.472 5.108 1.00 75.84 ? 106 GLU A CA 1 ATOM 836 C C . GLU A 1 106 ? 13.168 74.817 3.633 1.00 80.03 ? 106 GLU A C 1 ATOM 837 O O . GLU A 1 106 ? 12.381 74.346 2.816 1.00 80.89 ? 106 GLU A O 1 ATOM 838 C CB . GLU A 1 106 ? 12.984 72.967 5.316 1.00 61.52 ? 106 GLU A CB 1 ATOM 839 C CG . GLU A 1 106 ? 14.194 72.239 4.792 1.00 78.44 ? 106 GLU A CG 1 ATOM 840 C CD . GLU A 1 106 ? 14.375 70.890 5.447 1.00 89.65 ? 106 GLU A CD 1 ATOM 841 O OE1 . GLU A 1 106 ? 13.373 70.148 5.554 1.00 94.65 ? 106 GLU A OE1 1 ATOM 842 O OE2 . GLU A 1 106 ? 15.518 70.573 5.849 1.00 93.34 ? 106 GLU A OE2 1 ATOM 843 N N . ASN A 1 107 ? 14.145 75.658 3.304 1.00 64.20 ? 107 ASN A N 1 ATOM 844 C CA . ASN A 1 107 ? 14.349 76.100 1.926 1.00 61.31 ? 107 ASN A CA 1 ATOM 845 C C . ASN A 1 107 ? 13.196 77.033 1.583 1.00 58.03 ? 107 ASN A C 1 ATOM 846 O O . ASN A 1 107 ? 12.586 76.920 0.521 1.00 61.81 ? 107 ASN A O 1 ATOM 847 C CB . ASN A 1 107 ? 14.357 74.902 0.978 1.00 70.21 ? 107 ASN A CB 1 ATOM 848 C CG . ASN A 1 107 ? 15.384 73.864 1.373 1.00 81.87 ? 107 ASN A CG 1 ATOM 849 O OD1 . ASN A 1 107 ? 15.368 72.737 0.878 1.00 83.36 ? 107 ASN A OD1 1 ATOM 850 N ND2 . ASN A 1 107 ? 16.292 74.241 2.269 1.00 84.27 ? 107 ASN A ND2 1 ATOM 851 N N . ASN A 1 108 ? 12.905 77.947 2.507 1.00 52.16 ? 108 ASN A N 1 ATOM 852 C CA . ASN A 1 108 ? 11.828 78.917 2.357 1.00 59.97 ? 108 ASN A CA 1 ATOM 853 C C . ASN A 1 108 ? 10.460 78.236 2.184 1.00 61.88 ? 108 ASN A C 1 ATOM 854 O O . ASN A 1 108 ? 9.442 78.897 2.031 1.00 60.24 ? 108 ASN A O 1 ATOM 855 C CB . ASN A 1 108 ? 12.155 79.889 1.204 1.00 50.22 ? 108 ASN A CB 1 ATOM 856 C CG . ASN A 1 108 ? 10.939 80.673 0.721 1.00 66.98 ? 108 ASN A CG 1 ATOM 857 O OD1 . ASN A 1 108 ? 10.042 80.098 0.101 1.00 82.53 ? 108 ASN A OD1 1 ATOM 858 N ND2 . ASN A 1 108 ? 10.894 81.976 0.977 1.00 65.34 ? 108 ASN A ND2 1 ATOM 859 N N . ARG A 1 109 ? 10.428 76.909 2.243 1.00 50.59 ? 109 ARG A N 1 ATOM 860 C CA . ARG A 1 109 ? 9.165 76.178 2.125 1.00 55.49 ? 109 ARG A CA 1 ATOM 861 C C . ARG A 1 109 ? 8.668 75.729 3.515 1.00 48.43 ? 109 ARG A C 1 ATOM 862 O O . ARG A 1 109 ? 9.428 75.132 4.288 1.00 44.60 ? 109 ARG A O 1 ATOM 863 C CB . ARG A 1 109 ? 9.354 74.949 1.229 1.00 93.40 ? 109 ARG A CB 1 ATOM 864 C CG . ARG A 1 109 ? 9.764 75.260 -0.204 1.00 115.89 ? 109 ARG A CG 1 ATOM 865 C CD . ARG A 1 109 ? 8.594 75.761 -1.041 1.00 125.81 ? 109 ARG A CD 1 ATOM 866 N NE . ARG A 1 109 ? 9.000 76.067 -2.413 1.00 135.18 ? 109 ARG A NE 1 ATOM 867 C CZ . ARG A 1 109 ? 8.161 76.408 -3.388 1.00 140.35 ? 109 ARG A CZ 1 ATOM 868 N NH1 . ARG A 1 109 ? 6.858 76.488 -3.154 1.00 142.91 ? 109 ARG A NH1 1 ATOM 869 N NH2 . ARG A 1 109 ? 8.625 76.674 -4.601 1.00 140.51 ? 109 ARG A NH2 1 ATOM 870 N N . SER A 1 110 ? 7.409 76.020 3.846 1.00 38.47 ? 110 SER A N 1 ATOM 871 C CA . SER A 1 110 ? 6.871 75.600 5.143 1.00 38.10 ? 110 SER A CA 1 ATOM 872 C C . SER A 1 110 ? 6.999 74.089 5.235 1.00 40.41 ? 110 SER A C 1 ATOM 873 O O . SER A 1 110 ? 6.503 73.373 4.368 1.00 40.85 ? 110 SER A O 1 ATOM 874 C CB . SER A 1 110 ? 5.411 76.007 5.281 1.00 49.33 ? 110 SER A CB 1 ATOM 875 O OG . SER A 1 110 ? 5.311 77.406 5.457 1.00 50.38 ? 110 SER A OG 1 ATOM 876 N N . SER A 1 111 ? 7.663 73.602 6.282 1.00 33.00 ? 111 SER A N 1 ATOM 877 C CA . SER A 1 111 ? 7.892 72.169 6.443 1.00 33.00 ? 111 SER A CA 1 ATOM 878 C C . SER A 1 111 ? 7.194 71.529 7.625 1.00 33.00 ? 111 SER A C 1 ATOM 879 O O . SER A 1 111 ? 7.329 70.328 7.846 1.00 36.97 ? 111 SER A O 1 ATOM 880 C CB . SER A 1 111 ? 9.390 71.898 6.561 1.00 40.63 ? 111 SER A CB 1 ATOM 881 O OG . SER A 1 111 ? 9.909 72.481 7.740 1.00 43.05 ? 111 SER A OG 1 ATOM 882 N N . GLY A 1 112 ? 6.457 72.315 8.400 1.00 44.86 ? 112 GLY A N 1 ATOM 883 C CA . GLY A 1 112 ? 5.768 71.738 9.537 1.00 44.86 ? 112 GLY A CA 1 ATOM 884 C C . GLY A 1 112 ? 5.141 72.763 10.446 1.00 44.86 ? 112 GLY A C 1 ATOM 885 O O . GLY A 1 112 ? 5.521 73.936 10.439 1.00 44.86 ? 112 GLY A O 1 ATOM 886 N N . ALA A 1 113 ? 4.175 72.312 11.237 1.00 29.39 ? 113 ALA A N 1 ATOM 887 C CA . ALA A 1 113 ? 3.484 73.182 12.172 1.00 29.39 ? 113 ALA A CA 1 ATOM 888 C C . ALA A 1 113 ? 2.840 72.334 13.285 1.00 29.39 ? 113 ALA A C 1 ATOM 889 O O . ALA A 1 113 ? 2.523 71.165 13.082 1.00 29.39 ? 113 ALA A O 1 ATOM 890 C CB . ALA A 1 113 ? 2.442 74.000 11.424 1.00 10.42 ? 113 ALA A CB 1 ATOM 891 N N . PHE A 1 114 ? 2.658 72.913 14.466 1.00 27.22 ? 114 PHE A N 1 ATOM 892 C CA . PHE A 1 114 ? 2.079 72.158 15.574 1.00 27.22 ? 114 PHE A CA 1 ATOM 893 C C . PHE A 1 114 ? 1.374 73.043 16.581 1.00 27.22 ? 114 PHE A C 1 ATOM 894 O O . PHE A 1 114 ? 1.706 74.208 16.760 1.00 27.22 ? 114 PHE A O 1 ATOM 895 C CB . PHE A 1 114 ? 3.167 71.345 16.277 1.00 35.39 ? 114 PHE A CB 1 ATOM 896 C CG . PHE A 1 114 ? 4.356 72.155 16.664 1.00 35.39 ? 114 PHE A CG 1 ATOM 897 C CD1 . PHE A 1 114 ? 4.303 73.016 17.756 1.00 35.39 ? 114 PHE A CD1 1 ATOM 898 C CD2 . PHE A 1 114 ? 5.513 72.119 15.895 1.00 35.39 ? 114 PHE A CD2 1 ATOM 899 C CE1 . PHE A 1 114 ? 5.392 73.839 18.068 1.00 35.39 ? 114 PHE A CE1 1 ATOM 900 C CE2 . PHE A 1 114 ? 6.606 72.936 16.199 1.00 35.39 ? 114 PHE A CE2 1 ATOM 901 C CZ . PHE A 1 114 ? 6.547 73.797 17.282 1.00 35.39 ? 114 PHE A CZ 1 ATOM 902 N N . TRP A 1 115 ? 0.389 72.478 17.245 1.00 23.23 ? 115 TRP A N 1 ATOM 903 C CA . TRP A 1 115 ? -0.363 73.229 18.222 1.00 23.23 ? 115 TRP A CA 1 ATOM 904 C C . TRP A 1 115 ? -0.911 72.209 19.198 1.00 23.23 ? 115 TRP A C 1 ATOM 905 O O . TRP A 1 115 ? -1.889 71.528 18.898 1.00 23.23 ? 115 TRP A O 1 ATOM 906 C CB . TRP A 1 115 ? -1.500 73.945 17.524 1.00 25.15 ? 115 TRP A CB 1 ATOM 907 C CG . TRP A 1 115 ? -2.083 75.072 18.303 1.00 25.15 ? 115 TRP A CG 1 ATOM 908 C CD1 . TRP A 1 115 ? -2.034 75.266 19.666 1.00 25.15 ? 115 TRP A CD1 1 ATOM 909 C CD2 . TRP A 1 115 ? -2.844 76.156 17.770 1.00 25.15 ? 115 TRP A CD2 1 ATOM 910 N NE1 . TRP A 1 115 ? -2.721 76.410 20.003 1.00 25.15 ? 115 TRP A NE1 1 ATOM 911 C CE2 . TRP A 1 115 ? -3.229 76.974 18.860 1.00 25.15 ? 115 TRP A CE2 1 ATOM 912 C CE3 . TRP A 1 115 ? -3.243 76.518 16.474 1.00 25.15 ? 115 TRP A CE3 1 ATOM 913 C CZ2 . TRP A 1 115 ? -3.998 78.134 18.685 1.00 25.15 ? 115 TRP A CZ2 1 ATOM 914 C CZ3 . TRP A 1 115 ? -4.006 77.669 16.305 1.00 25.15 ? 115 TRP A CZ3 1 ATOM 915 C CH2 . TRP A 1 115 ? -4.373 78.460 17.401 1.00 25.15 ? 115 TRP A CH2 1 ATOM 916 N N . LYS A 1 116 ? -0.284 72.095 20.364 1.00 31.40 ? 116 LYS A N 1 ATOM 917 C CA . LYS A 1 116 ? -0.727 71.111 21.344 1.00 31.40 ? 116 LYS A CA 1 ATOM 918 C C . LYS A 1 116 ? -0.748 71.603 22.784 1.00 31.40 ? 116 LYS A C 1 ATOM 919 O O . LYS A 1 116 ? 0.033 72.464 23.172 1.00 31.40 ? 116 LYS A O 1 ATOM 920 C CB . LYS A 1 116 ? 0.166 69.883 21.235 1.00 19.42 ? 116 LYS A CB 1 ATOM 921 C CG . LYS A 1 116 ? -0.298 68.707 22.035 1.00 19.42 ? 116 LYS A CG 1 ATOM 922 C CD . LYS A 1 116 ? 0.543 67.517 21.681 1.00 19.42 ? 116 LYS A CD 1 ATOM 923 C CE . LYS A 1 116 ? 0.034 66.279 22.365 1.00 19.42 ? 116 LYS A CE 1 ATOM 924 N NZ . LYS A 1 116 ? 0.909 65.123 22.051 1.00 19.42 ? 116 LYS A NZ 1 ATOM 925 N N . TYR A 1 117 ? -1.649 71.036 23.578 1.00 25.41 ? 117 TYR A N 1 ATOM 926 C CA . TYR A 1 117 ? -1.790 71.391 24.993 1.00 25.41 ? 117 TYR A CA 1 ATOM 927 C C . TYR A 1 117 ? -1.622 70.180 25.912 1.00 25.41 ? 117 TYR A C 1 ATOM 928 O O . TYR A 1 117 ? -1.972 69.053 25.561 1.00 25.41 ? 117 TYR A O 1 ATOM 929 C CB . TYR A 1 117 ? -3.163 72.017 25.253 1.00 22.59 ? 117 TYR A CB 1 ATOM 930 C CG . TYR A 1 117 ? -3.366 73.347 24.581 1.00 22.59 ? 117 TYR A CG 1 ATOM 931 C CD1 . TYR A 1 117 ? -3.852 73.425 23.272 1.00 22.59 ? 117 TYR A CD1 1 ATOM 932 C CD2 . TYR A 1 117 ? -3.028 74.536 25.232 1.00 22.59 ? 117 TYR A CD2 1 ATOM 933 C CE1 . TYR A 1 117 ? -3.994 74.657 22.626 1.00 22.59 ? 117 TYR A CE1 1 ATOM 934 C CE2 . TYR A 1 117 ? -3.163 75.763 24.594 1.00 22.59 ? 117 TYR A CE2 1 ATOM 935 C CZ . TYR A 1 117 ? -3.645 75.808 23.292 1.00 22.59 ? 117 TYR A CZ 1 ATOM 936 O OH . TYR A 1 117 ? -3.751 77.008 22.655 1.00 22.59 ? 117 TYR A OH 1 ATOM 937 N N . TYR A 1 118 ? -1.087 70.425 27.099 1.00 18.73 ? 118 TYR A N 1 ATOM 938 C CA . TYR A 1 118 ? -0.890 69.365 28.080 1.00 18.73 ? 118 TYR A CA 1 ATOM 939 C C . TYR A 1 118 ? -1.478 69.806 29.415 1.00 18.73 ? 118 TYR A C 1 ATOM 940 O O . TYR A 1 118 ? -1.265 70.943 29.857 1.00 18.73 ? 118 TYR A O 1 ATOM 941 C CB . TYR A 1 118 ? 0.603 69.067 28.266 1.00 22.78 ? 118 TYR A CB 1 ATOM 942 C CG . TYR A 1 118 ? 1.339 68.863 26.976 1.00 22.78 ? 118 TYR A CG 1 ATOM 943 C CD1 . TYR A 1 118 ? 1.618 69.943 26.138 1.00 22.78 ? 118 TYR A CD1 1 ATOM 944 C CD2 . TYR A 1 118 ? 1.694 67.589 26.546 1.00 22.78 ? 118 TYR A CD2 1 ATOM 945 C CE1 . TYR A 1 118 ? 2.231 69.759 24.889 1.00 22.78 ? 118 TYR A CE1 1 ATOM 946 C CE2 . TYR A 1 118 ? 2.301 67.393 25.301 1.00 22.78 ? 118 TYR A CE2 1 ATOM 947 C CZ . TYR A 1 118 ? 2.566 68.484 24.484 1.00 22.78 ? 118 TYR A CZ 1 ATOM 948 O OH . TYR A 1 118 ? 3.194 68.310 23.274 1.00 22.78 ? 118 TYR A OH 1 ATOM 949 N N . TYR A 1 119 ? -2.229 68.914 30.047 1.00 20.97 ? 119 TYR A N 1 ATOM 950 C CA . TYR A 1 119 ? -2.816 69.196 31.347 1.00 20.97 ? 119 TYR A CA 1 ATOM 951 C C . TYR A 1 119 ? -2.185 68.228 32.359 1.00 20.97 ? 119 TYR A C 1 ATOM 952 O O . TYR A 1 119 ? -2.201 67.001 32.162 1.00 20.97 ? 119 TYR A O 1 ATOM 953 C CB . TYR A 1 119 ? -4.327 69.014 31.306 1.00 26.62 ? 119 TYR A CB 1 ATOM 954 C CG . TYR A 1 119 ? -4.967 69.198 32.655 1.00 26.62 ? 119 TYR A CG 1 ATOM 955 C CD1 . TYR A 1 119 ? -4.937 70.438 33.306 1.00 26.62 ? 119 TYR A CD1 1 ATOM 956 C CD2 . TYR A 1 119 ? -5.600 68.137 33.290 1.00 26.62 ? 119 TYR A CD2 1 ATOM 957 C CE1 . TYR A 1 119 ? -5.529 70.609 34.562 1.00 26.62 ? 119 TYR A CE1 1 ATOM 958 C CE2 . TYR A 1 119 ? -6.196 68.293 34.535 1.00 26.62 ? 119 TYR A CE2 1 ATOM 959 C CZ . TYR A 1 119 ? -6.161 69.526 35.171 1.00 26.62 ? 119 TYR A CZ 1 ATOM 960 O OH . TYR A 1 119 ? -6.776 69.657 36.406 1.00 26.62 ? 119 TYR A OH 1 ATOM 961 N N . ASP A 1 120 ? -1.626 68.787 33.433 1.00 32.14 ? 120 ASP A N 1 ATOM 962 C CA . ASP A 1 120 ? -0.952 67.995 34.461 1.00 32.14 ? 120 ASP A CA 1 ATOM 963 C C . ASP A 1 120 ? 0.007 67.013 33.794 1.00 32.14 ? 120 ASP A C 1 ATOM 964 O O . ASP A 1 120 ? 0.155 65.861 34.207 1.00 32.14 ? 120 ASP A O 1 ATOM 965 C CB . ASP A 1 120 ? -1.959 67.247 35.339 1.00 45.94 ? 120 ASP A CB 1 ATOM 966 C CG . ASP A 1 120 ? -2.633 68.156 36.360 1.00 45.94 ? 120 ASP A CG 1 ATOM 967 O OD1 . ASP A 1 120 ? -2.056 69.225 36.695 1.00 45.94 ? 120 ASP A OD1 1 ATOM 968 O OD2 . ASP A 1 120 ? -3.734 67.792 36.844 1.00 45.94 ? 120 ASP A OD2 1 ATOM 969 N N . GLY A 1 121 ? 0.660 67.486 32.741 1.00 21.31 ? 121 GLY A N 1 ATOM 970 C CA . GLY A 1 121 ? 1.594 66.639 32.028 1.00 21.31 ? 121 GLY A CA 1 ATOM 971 C C . GLY A 1 121 ? 1.058 65.680 30.968 1.00 21.31 ? 121 GLY A C 1 ATOM 972 O O . GLY A 1 121 ? 1.854 65.114 30.235 1.00 21.31 ? 121 GLY A O 1 ATOM 973 N N . LYS A 1 122 ? -0.253 65.467 30.885 1.00 30.22 ? 122 LYS A N 1 ATOM 974 C CA . LYS A 1 122 ? -0.786 64.543 29.873 1.00 30.22 ? 122 LYS A CA 1 ATOM 975 C C . LYS A 1 122 ? -1.350 65.285 28.668 1.00 30.22 ? 122 LYS A C 1 ATOM 976 O O . LYS A 1 122 ? -1.780 66.437 28.772 1.00 30.22 ? 122 LYS A O 1 ATOM 977 C CB . LYS A 1 122 ? -1.897 63.645 30.443 1.00 44.76 ? 122 LYS A CB 1 ATOM 978 C CG . LYS A 1 122 ? -1.535 62.836 31.670 1.00 45.29 ? 122 LYS A CG 1 ATOM 979 C CD . LYS A 1 122 ? -1.609 63.704 32.921 1.00 77.25 ? 122 LYS A CD 1 ATOM 980 C CE . LYS A 1 122 ? -1.265 62.927 34.187 1.00 87.66 ? 122 LYS A CE 1 ATOM 981 N NZ . LYS A 1 122 ? -1.302 63.800 35.402 1.00 73.51 ? 122 LYS A NZ 1 ATOM 982 N N . ASP A 1 123 ? -1.351 64.620 27.520 1.00 28.22 ? 123 ASP A N 1 ATOM 983 C CA . ASP A 1 123 ? -1.900 65.230 26.310 1.00 28.22 ? 123 ASP A CA 1 ATOM 984 C C . ASP A 1 123 ? -3.354 65.644 26.601 1.00 28.22 ? 123 ASP A C 1 ATOM 985 O O . ASP A 1 123 ? -4.140 64.861 27.128 1.00 28.22 ? 123 ASP A O 1 ATOM 986 C CB . ASP A 1 123 ? -1.836 64.240 25.142 1.00 37.66 ? 123 ASP A CB 1 ATOM 987 C CG . ASP A 1 123 ? -0.400 63.932 24.710 1.00 37.66 ? 123 ASP A CG 1 ATOM 988 O OD1 . ASP A 1 123 ? 0.518 64.711 25.038 1.00 37.66 ? 123 ASP A OD1 1 ATOM 989 O OD2 . ASP A 1 123 ? -0.177 62.915 24.019 1.00 37.66 ? 123 ASP A OD2 1 ATOM 990 N N . TYR A 1 124 ? -3.695 66.888 26.287 1.00 28.46 ? 124 TYR A N 1 ATOM 991 C CA . TYR A 1 124 ? -5.037 67.378 26.536 1.00 28.46 ? 124 TYR A CA 1 ATOM 992 C C . TYR A 1 124 ? -5.815 67.557 25.233 1.00 28.46 ? 124 TYR A C 1 ATOM 993 O O . TYR A 1 124 ? -6.918 67.012 25.064 1.00 28.46 ? 124 TYR A O 1 ATOM 994 C CB . TYR A 1 124 ? -4.979 68.718 27.286 1.00 23.87 ? 124 TYR A CB 1 ATOM 995 C CG . TYR A 1 124 ? -6.350 69.267 27.644 1.00 23.87 ? 124 TYR A CG 1 ATOM 996 C CD1 . TYR A 1 124 ? -7.163 68.614 28.572 1.00 23.87 ? 124 TYR A CD1 1 ATOM 997 C CD2 . TYR A 1 124 ? -6.853 70.412 27.017 1.00 23.87 ? 124 TYR A CD2 1 ATOM 998 C CE1 . TYR A 1 124 ? -8.442 69.075 28.861 1.00 23.87 ? 124 TYR A CE1 1 ATOM 999 C CE2 . TYR A 1 124 ? -8.127 70.888 27.298 1.00 23.87 ? 124 TYR A CE2 1 ATOM 1000 C CZ . TYR A 1 124 ? -8.926 70.213 28.216 1.00 23.87 ? 124 TYR A CZ 1 ATOM 1001 O OH . TYR A 1 124 ? -10.224 70.639 28.451 1.00 23.87 ? 124 TYR A OH 1 ATOM 1002 N N . ILE A 1 125 ? -5.237 68.332 24.315 1.00 33.15 ? 125 ILE A N 1 ATOM 1003 C CA . ILE A 1 125 ? -5.883 68.600 23.042 1.00 33.15 ? 125 ILE A CA 1 ATOM 1004 C C . ILE A 1 125 ? -4.835 69.094 22.054 1.00 33.15 ? 125 ILE A C 1 ATOM 1005 O O . ILE A 1 125 ? -3.805 69.646 22.452 1.00 33.15 ? 125 ILE A O 1 ATOM 1006 C CB . ILE A 1 125 ? -6.995 69.673 23.221 1.00 17.76 ? 125 ILE A CB 1 ATOM 1007 C CG1 . ILE A 1 125 ? -8.006 69.561 22.086 1.00 17.76 ? 125 ILE A CG1 1 ATOM 1008 C CG2 . ILE A 1 125 ? -6.395 71.093 23.245 1.00 17.76 ? 125 ILE A CG2 1 ATOM 1009 C CD1 . ILE A 1 125 ? -9.156 70.566 22.186 1.00 17.76 ? 125 ILE A CD1 1 ATOM 1010 N N . GLU A 1 126 ? -5.075 68.869 20.769 1.00 24.29 ? 126 GLU A N 1 ATOM 1011 C CA . GLU A 1 126 ? -4.146 69.329 19.750 1.00 24.29 ? 126 GLU A CA 1 ATOM 1012 C C . GLU A 1 126 ? -4.914 69.635 18.472 1.00 24.29 ? 126 GLU A C 1 ATOM 1013 O O . GLU A 1 126 ? -5.994 69.078 18.217 1.00 24.29 ? 126 GLU A O 1 ATOM 1014 C CB . GLU A 1 126 ? -3.054 68.290 19.478 1.00 47.74 ? 126 GLU A CB 1 ATOM 1015 C CG . GLU A 1 126 ? -3.508 67.108 18.662 1.00 47.74 ? 126 GLU A CG 1 ATOM 1016 C CD . GLU A 1 126 ? -2.391 66.115 18.368 1.00 50.26 ? 126 GLU A CD 1 ATOM 1017 O OE1 . GLU A 1 126 ? -2.687 65.079 17.721 1.00 47.74 ? 126 GLU A OE1 1 ATOM 1018 O OE2 . GLU A 1 126 ? -1.231 66.365 18.779 1.00 47.74 ? 126 GLU A OE2 1 ATOM 1019 N N . PHE A 1 127 ? -4.359 70.516 17.659 1.00 22.82 ? 127 PHE A N 1 ATOM 1020 C CA . PHE A 1 127 ? -5.030 70.895 16.430 1.00 22.82 ? 127 PHE A CA 1 ATOM 1021 C C . PHE A 1 127 ? -4.575 70.127 15.184 1.00 22.82 ? 127 PHE A C 1 ATOM 1022 O O . PHE A 1 127 ? -3.391 70.035 14.902 1.00 22.82 ? 127 PHE A O 1 ATOM 1023 C CB . PHE A 1 127 ? -4.822 72.389 16.210 1.00 23.36 ? 127 PHE A CB 1 ATOM 1024 C CG . PHE A 1 127 ? -5.577 72.936 15.044 1.00 23.36 ? 127 PHE A CG 1 ATOM 1025 C CD1 . PHE A 1 127 ? -6.969 72.981 15.068 1.00 23.36 ? 127 PHE A CD1 1 ATOM 1026 C CD2 . PHE A 1 127 ? -4.901 73.389 13.919 1.00 23.36 ? 127 PHE A CD2 1 ATOM 1027 C CE1 . PHE A 1 127 ? -7.682 73.470 13.978 1.00 23.36 ? 127 PHE A CE1 1 ATOM 1028 C CE2 . PHE A 1 127 ? -5.595 73.876 12.832 1.00 23.36 ? 127 PHE A CE2 1 ATOM 1029 C CZ . PHE A 1 127 ? -6.996 73.917 12.859 1.00 23.36 ? 127 PHE A CZ 1 ATOM 1030 N N . ASN A 1 128 ? -5.509 69.564 14.435 1.00 27.05 ? 128 ASN A N 1 ATOM 1031 C CA . ASN A 1 128 ? -5.128 68.871 13.210 1.00 27.05 ? 128 ASN A CA 1 ATOM 1032 C C . ASN A 1 128 ? -5.575 69.752 12.034 1.00 27.05 ? 128 ASN A C 1 ATOM 1033 O O . ASN A 1 128 ? -6.753 69.809 11.693 1.00 27.05 ? 128 ASN A O 1 ATOM 1034 C CB . ASN A 1 128 ? -5.791 67.511 13.125 1.00 27.83 ? 128 ASN A CB 1 ATOM 1035 C CG . ASN A 1 128 ? -5.375 66.761 11.890 1.00 27.83 ? 128 ASN A CG 1 ATOM 1036 O OD1 . ASN A 1 128 ? -5.422 67.310 10.788 1.00 27.83 ? 128 ASN A OD1 1 ATOM 1037 N ND2 . ASN A 1 128 ? -4.964 65.507 12.054 1.00 27.83 ? 128 ASN A ND2 1 ATOM 1038 N N . LYS A 1 129 ? -4.630 70.449 11.422 1.00 27.69 ? 129 LYS A N 1 ATOM 1039 C CA . LYS A 1 129 ? -4.956 71.351 10.333 1.00 27.69 ? 129 LYS A CA 1 ATOM 1040 C C . LYS A 1 129 ? -5.426 70.702 9.034 1.00 27.69 ? 129 LYS A C 1 ATOM 1041 O O . LYS A 1 129 ? -5.921 71.396 8.145 1.00 27.69 ? 129 LYS A O 1 ATOM 1042 C CB . LYS A 1 129 ? -3.763 72.261 10.045 1.00 32.98 ? 129 LYS A CB 1 ATOM 1043 C CG . LYS A 1 129 ? -2.620 71.603 9.333 1.00 32.98 ? 129 LYS A CG 1 ATOM 1044 C CD . LYS A 1 129 ? -1.408 72.522 9.376 1.00 32.98 ? 129 LYS A CD 1 ATOM 1045 C CE . LYS A 1 129 ? -0.270 71.993 8.520 1.00 33.51 ? 129 LYS A CE 1 ATOM 1046 N NZ . LYS A 1 129 ? -0.722 71.891 7.093 1.00 39.65 ? 129 LYS A NZ 1 ATOM 1047 N N . GLU A 1 130 ? -5.289 69.386 8.920 1.00 33.95 ? 130 GLU A N 1 ATOM 1048 C CA . GLU A 1 130 ? -5.705 68.713 7.702 1.00 33.95 ? 130 GLU A CA 1 ATOM 1049 C C . GLU A 1 130 ? -7.213 68.475 7.659 1.00 33.95 ? 130 GLU A C 1 ATOM 1050 O O . GLU A 1 130 ? -7.809 68.412 6.584 1.00 33.95 ? 130 GLU A O 1 ATOM 1051 C CB . GLU A 1 130 ? -4.977 67.377 7.550 1.00 51.00 ? 130 GLU A CB 1 ATOM 1052 C CG . GLU A 1 130 ? -5.172 66.742 6.177 1.00 51.00 ? 130 GLU A CG 1 ATOM 1053 C CD . GLU A 1 130 ? -4.558 65.350 6.063 1.00 56.75 ? 130 GLU A CD 1 ATOM 1054 O OE1 . GLU A 1 130 ? -5.103 64.397 6.667 1.00 51.00 ? 130 GLU A OE1 1 ATOM 1055 O OE2 . GLU A 1 130 ? -3.523 65.210 5.369 1.00 51.00 ? 130 GLU A OE2 1 ATOM 1056 N N . ILE A 1 131 ? -7.834 68.360 8.825 1.00 40.37 ? 131 ILE A N 1 ATOM 1057 C CA . ILE A 1 131 ? -9.262 68.099 8.885 1.00 40.37 ? 131 ILE A CA 1 ATOM 1058 C C . ILE A 1 131 ? -10.165 69.236 8.404 1.00 40.37 ? 131 ILE A C 1 ATOM 1059 O O . ILE A 1 131 ? -10.961 69.045 7.487 1.00 40.37 ? 131 ILE A O 1 ATOM 1060 C CB . ILE A 1 131 ? -9.647 67.652 10.299 1.00 20.42 ? 131 ILE A CB 1 ATOM 1061 C CG1 . ILE A 1 131 ? -8.937 66.318 10.591 1.00 20.42 ? 131 ILE A CG1 1 ATOM 1062 C CG2 . ILE A 1 131 ? -11.175 67.560 10.424 1.00 20.42 ? 131 ILE A CG2 1 ATOM 1063 C CD1 . ILE A 1 131 ? -9.111 65.766 11.990 1.00 20.42 ? 131 ILE A CD1 1 ATOM 1064 N N . PRO A 1 132 ? -10.079 70.428 9.015 1.00 26.65 ? 132 PRO A N 1 ATOM 1065 C CA . PRO A 1 132 ? -9.229 70.870 10.130 1.00 26.65 ? 132 PRO A CA 1 ATOM 1066 C C . PRO A 1 132 ? -10.055 70.912 11.409 1.00 26.65 ? 132 PRO A C 1 ATOM 1067 O O . PRO A 1 132 ? -11.220 71.299 11.377 1.00 26.65 ? 132 PRO A O 1 ATOM 1068 C CB . PRO A 1 132 ? -8.804 72.258 9.690 1.00 13.87 ? 132 PRO A CB 1 ATOM 1069 C CG . PRO A 1 132 ? -10.078 72.783 9.073 1.00 13.87 ? 132 PRO A CG 1 ATOM 1070 C CD . PRO A 1 132 ? -10.678 71.589 8.324 1.00 13.87 ? 132 PRO A CD 1 ATOM 1071 N N . ALA A 1 133 ? -9.470 70.516 12.533 1.00 26.41 ? 133 ALA A N 1 ATOM 1072 C CA . ALA A 1 133 ? -10.218 70.534 13.796 1.00 26.41 ? 133 ALA A CA 1 ATOM 1073 C C . ALA A 1 133 ? -9.366 70.181 14.983 1.00 26.41 ? 133 ALA A C 1 ATOM 1074 O O . ALA A 1 133 ? -8.221 69.746 14.835 1.00 26.41 ? 133 ALA A O 1 ATOM 1075 C CB . ALA A 1 133 ? -11.393 69.567 13.737 1.00 1.51 ? 133 ALA A CB 1 ATOM 1076 N N . TRP A 1 134 ? -9.929 70.370 16.172 1.00 24.58 ? 134 TRP A N 1 ATOM 1077 C CA . TRP A 1 134 ? -9.205 70.025 17.382 1.00 24.58 ? 134 TRP A CA 1 ATOM 1078 C C . TRP A 1 134 ? -9.476 68.565 17.681 1.00 24.58 ? 134 TRP A C 1 ATOM 1079 O O . TRP A 1 134 ? -10.529 68.039 17.317 1.00 24.58 ? 134 TRP A O 1 ATOM 1080 C CB . TRP A 1 134 ? -9.639 70.903 18.552 1.00 18.96 ? 134 TRP A CB 1 ATOM 1081 C CG . TRP A 1 134 ? -9.191 72.319 18.373 1.00 18.96 ? 134 TRP A CG 1 ATOM 1082 C CD1 . TRP A 1 134 ? -9.883 73.328 17.765 1.00 18.96 ? 134 TRP A CD1 1 ATOM 1083 C CD2 . TRP A 1 134 ? -7.914 72.867 18.737 1.00 18.96 ? 134 TRP A CD2 1 ATOM 1084 N NE1 . TRP A 1 134 ? -9.120 74.469 17.728 1.00 18.96 ? 134 TRP A NE1 1 ATOM 1085 C CE2 . TRP A 1 134 ? -7.905 74.217 18.311 1.00 18.96 ? 134 TRP A CE2 1 ATOM 1086 C CE3 . TRP A 1 134 ? -6.777 72.346 19.378 1.00 18.96 ? 134 TRP A CE3 1 ATOM 1087 C CZ2 . TRP A 1 134 ? -6.794 75.063 18.502 1.00 18.96 ? 134 TRP A CZ2 1 ATOM 1088 C CZ3 . TRP A 1 134 ? -5.675 73.175 19.572 1.00 18.96 ? 134 TRP A CZ3 1 ATOM 1089 C CH2 . TRP A 1 134 ? -5.689 74.527 19.132 1.00 18.96 ? 134 TRP A CH2 1 ATOM 1090 N N . VAL A 1 135 ? -8.504 67.917 18.315 1.00 30.94 ? 135 VAL A N 1 ATOM 1091 C CA . VAL A 1 135 ? -8.617 66.514 18.674 1.00 30.94 ? 135 VAL A CA 1 ATOM 1092 C C . VAL A 1 135 ? -8.492 66.406 20.184 1.00 30.94 ? 135 VAL A C 1 ATOM 1093 O O . VAL A 1 135 ? -7.445 66.694 20.749 1.00 30.94 ? 135 VAL A O 1 ATOM 1094 C CB . VAL A 1 135 ? -7.497 65.678 18.004 1.00 27.08 ? 135 VAL A CB 1 ATOM 1095 C CG1 . VAL A 1 135 ? -7.587 64.234 18.456 1.00 27.08 ? 135 VAL A CG1 1 ATOM 1096 C CG2 . VAL A 1 135 ? -7.610 65.768 16.488 1.00 27.08 ? 135 VAL A CG2 1 ATOM 1097 N N . PRO A 1 136 ? -9.561 65.988 20.864 1.00 37.53 ? 136 PRO A N 1 ATOM 1098 C CA . PRO A 1 136 ? -9.474 65.877 22.324 1.00 37.53 ? 136 PRO A CA 1 ATOM 1099 C C . PRO A 1 136 ? -8.805 64.575 22.753 1.00 37.53 ? 136 PRO A C 1 ATOM 1100 O O . PRO A 1 136 ? -8.967 63.548 22.101 1.00 37.53 ? 136 PRO A O 1 ATOM 1101 C CB . PRO A 1 136 ? -10.935 65.942 22.753 1.00 35.83 ? 136 PRO A CB 1 ATOM 1102 C CG . PRO A 1 136 ? -11.602 65.159 21.663 1.00 35.83 ? 136 PRO A CG 1 ATOM 1103 C CD . PRO A 1 136 ? -10.919 65.670 20.387 1.00 35.83 ? 136 PRO A CD 1 ATOM 1104 N N . PHE A 1 137 ? -8.047 64.621 23.844 1.00 32.26 ? 137 PHE A N 1 ATOM 1105 C CA . PHE A 1 137 ? -7.391 63.426 24.349 1.00 32.26 ? 137 PHE A CA 1 ATOM 1106 C C . PHE A 1 137 ? -7.882 63.156 25.753 1.00 32.26 ? 137 PHE A C 1 ATOM 1107 O O . PHE A 1 137 ? -7.854 62.027 26.236 1.00 44.93 ? 137 PHE A O 1 ATOM 1108 C CB . PHE A 1 137 ? -5.880 63.606 24.359 1.00 27.86 ? 137 PHE A CB 1 ATOM 1109 C CG . PHE A 1 137 ? -5.291 63.766 23.000 1.00 27.86 ? 137 PHE A CG 1 ATOM 1110 C CD1 . PHE A 1 137 ? -5.417 62.749 22.048 1.00 27.86 ? 137 PHE A CD1 1 ATOM 1111 C CD2 . PHE A 1 137 ? -4.608 64.929 22.658 1.00 27.86 ? 137 PHE A CD2 1 ATOM 1112 C CE1 . PHE A 1 137 ? -4.870 62.878 20.773 1.00 27.86 ? 137 PHE A CE1 1 ATOM 1113 C CE2 . PHE A 1 137 ? -4.053 65.077 21.383 1.00 27.86 ? 137 PHE A CE2 1 ATOM 1114 C CZ . PHE A 1 137 ? -4.185 64.044 20.437 1.00 27.86 ? 137 PHE A CZ 1 ATOM 1115 N N . ASP A 1 138 ? -8.341 64.213 26.399 1.00 38.13 ? 138 ASP A N 1 ATOM 1116 C CA . ASP A 1 138 ? -8.846 64.139 27.752 1.00 38.13 ? 138 ASP A CA 1 ATOM 1117 C C . ASP A 1 138 ? -10.335 64.481 27.718 1.00 38.13 ? 138 ASP A C 1 ATOM 1118 O O . ASP A 1 138 ? -10.757 65.364 26.973 1.00 38.13 ? 138 ASP A O 1 ATOM 1119 C CB . ASP A 1 138 ? -8.070 65.136 28.626 1.00 45.76 ? 138 ASP A CB 1 ATOM 1120 C CG . ASP A 1 138 ? -8.629 65.253 30.035 1.00 45.76 ? 138 ASP A CG 1 ATOM 1121 O OD1 . ASP A 1 138 ? -9.785 65.708 30.182 1.00 45.76 ? 138 ASP A OD1 1 ATOM 1122 O OD2 . ASP A 1 138 ? -7.907 64.899 30.994 1.00 45.76 ? 138 ASP A OD2 1 ATOM 1123 N N . PRO A 1 139 ? -11.157 63.770 28.505 1.00 33.91 ? 139 PRO A N 1 ATOM 1124 C CA . PRO A 1 139 ? -12.591 64.078 28.500 1.00 33.91 ? 139 PRO A CA 1 ATOM 1125 C C . PRO A 1 139 ? -12.944 65.569 28.621 1.00 33.91 ? 139 PRO A C 1 ATOM 1126 O O . PRO A 1 139 ? -13.827 66.050 27.920 1.00 33.91 ? 139 PRO A O 1 ATOM 1127 C CB . PRO A 1 139 ? -13.139 63.229 29.657 1.00 31.65 ? 139 PRO A CB 1 ATOM 1128 C CG . PRO A 1 139 ? -11.894 62.758 30.416 1.00 40.20 ? 139 PRO A CG 1 ATOM 1129 C CD . PRO A 1 139 ? -10.879 62.593 29.339 1.00 32.86 ? 139 PRO A CD 1 ATOM 1130 N N . ALA A 1 140 ? -12.267 66.310 29.490 1.00 29.71 ? 140 ALA A N 1 ATOM 1131 C CA . ALA A 1 140 ? -12.578 67.732 29.615 1.00 29.71 ? 140 ALA A CA 1 ATOM 1132 C C . ALA A 1 140 ? -12.268 68.468 28.297 1.00 29.71 ? 140 ALA A C 1 ATOM 1133 O O . ALA A 1 140 ? -12.767 69.572 28.049 1.00 29.71 ? 140 ALA A O 1 ATOM 1134 C CB . ALA A 1 140 ? -11.786 68.358 30.785 1.00 14.26 ? 140 ALA A CB 1 ATOM 1135 N N . ALA A 1 141 ? -11.445 67.851 27.452 1.00 25.81 ? 141 ALA A N 1 ATOM 1136 C CA . ALA A 1 141 ? -11.088 68.448 26.177 1.00 25.81 ? 141 ALA A CA 1 ATOM 1137 C C . ALA A 1 141 ? -12.306 68.466 25.253 1.00 25.81 ? 141 ALA A C 1 ATOM 1138 O O . ALA A 1 141 ? -12.395 69.295 24.332 1.00 25.81 ? 141 ALA A O 1 ATOM 1139 C CB . ALA A 1 141 ? -9.955 67.684 25.548 1.00 22.85 ? 141 ALA A CB 1 ATOM 1140 N N . GLN A 1 142 ? -13.249 67.557 25.493 1.00 24.92 ? 142 GLN A N 1 ATOM 1141 C CA . GLN A 1 142 ? -14.460 67.538 24.681 1.00 24.92 ? 142 GLN A CA 1 ATOM 1142 C C . GLN A 1 142 ? -15.185 68.860 24.860 1.00 24.92 ? 142 GLN A C 1 ATOM 1143 O O . GLN A 1 142 ? -15.721 69.408 23.902 1.00 24.92 ? 142 GLN A O 1 ATOM 1144 C CB . GLN A 1 142 ? -15.368 66.386 25.075 1.00 31.52 ? 142 GLN A CB 1 ATOM 1145 C CG . GLN A 1 142 ? -14.961 65.075 24.453 1.00 31.52 ? 142 GLN A CG 1 ATOM 1146 C CD . GLN A 1 142 ? -15.567 63.884 25.164 1.00 31.52 ? 142 GLN A CD 1 ATOM 1147 O OE1 . GLN A 1 142 ? -16.759 63.877 25.506 1.00 31.52 ? 142 GLN A OE1 1 ATOM 1148 N NE2 . GLN A 1 142 ? -14.749 62.861 25.391 1.00 31.52 ? 142 GLN A NE2 1 ATOM 1149 N N . ILE A 1 143 ? -15.189 69.383 26.085 1.00 22.49 ? 143 ILE A N 1 ATOM 1150 C CA . ILE A 1 143 ? -15.835 70.665 26.335 1.00 22.49 ? 143 ILE A CA 1 ATOM 1151 C C . ILE A 1 143 ? -15.028 71.780 25.656 1.00 22.49 ? 143 ILE A C 1 ATOM 1152 O O . ILE A 1 143 ? -15.589 72.609 24.932 1.00 22.49 ? 143 ILE A O 1 ATOM 1153 C CB . ILE A 1 143 ? -15.940 70.987 27.871 1.00 20.76 ? 143 ILE A CB 1 ATOM 1154 C CG1 . ILE A 1 143 ? -16.737 69.906 28.598 1.00 20.76 ? 143 ILE A CG1 1 ATOM 1155 C CG2 . ILE A 1 143 ? -16.624 72.329 28.078 1.00 20.76 ? 143 ILE A CG2 1 ATOM 1156 C CD1 . ILE A 1 143 ? -18.112 69.730 28.051 1.00 33.45 ? 143 ILE A CD1 1 ATOM 1157 N N . THR A 1 144 ? -13.717 71.803 25.902 1.00 24.52 ? 144 THR A N 1 ATOM 1158 C CA . THR A 1 144 ? -12.844 72.816 25.317 1.00 24.52 ? 144 THR A CA 1 ATOM 1159 C C . THR A 1 144 ? -13.013 72.868 23.793 1.00 24.52 ? 144 THR A C 1 ATOM 1160 O O . THR A 1 144 ? -13.095 73.956 23.197 1.00 24.52 ? 144 THR A O 1 ATOM 1161 C CB . THR A 1 144 ? -11.357 72.527 25.616 1.00 29.16 ? 144 THR A CB 1 ATOM 1162 O OG1 . THR A 1 144 ? -11.147 72.472 27.029 1.00 29.16 ? 144 THR A OG1 1 ATOM 1163 C CG2 . THR A 1 144 ? -10.474 73.629 25.030 1.00 29.16 ? 144 THR A CG2 1 ATOM 1164 N N . LYS A 1 145 ? -13.041 71.689 23.170 1.00 20.81 ? 145 LYS A N 1 ATOM 1165 C CA . LYS A 1 145 ? -13.200 71.597 21.732 1.00 20.81 ? 145 LYS A CA 1 ATOM 1166 C C . LYS A 1 145 ? -14.526 72.207 21.312 1.00 20.81 ? 145 LYS A C 1 ATOM 1167 O O . LYS A 1 145 ? -14.593 72.953 20.326 1.00 20.81 ? 145 LYS A O 1 ATOM 1168 C CB . LYS A 1 145 ? -13.140 70.130 21.292 1.00 26.28 ? 145 LYS A CB 1 ATOM 1169 C CG . LYS A 1 145 ? -13.462 69.855 19.820 1.00 26.28 ? 145 LYS A CG 1 ATOM 1170 C CD . LYS A 1 145 ? -13.347 68.353 19.571 1.00 26.28 ? 145 LYS A CD 1 ATOM 1171 C CE . LYS A 1 145 ? -13.971 67.932 18.238 1.00 26.28 ? 145 LYS A CE 1 ATOM 1172 N NZ . LYS A 1 145 ? -13.362 68.617 17.075 1.00 26.28 ? 145 LYS A NZ 1 ATOM 1173 N N . GLN A 1 146 ? -15.581 71.888 22.054 1.00 32.81 ? 146 GLN A N 1 ATOM 1174 C CA . GLN A 1 146 ? -16.891 72.420 21.734 1.00 32.81 ? 146 GLN A CA 1 ATOM 1175 C C . GLN A 1 146 ? -16.802 73.943 21.725 1.00 32.81 ? 146 GLN A C 1 ATOM 1176 O O . GLN A 1 146 ? -17.353 74.593 20.835 1.00 32.81 ? 146 GLN A O 1 ATOM 1177 C CB . GLN A 1 146 ? -17.929 71.950 22.755 1.00 37.95 ? 146 GLN A CB 1 ATOM 1178 C CG . GLN A 1 146 ? -19.325 71.753 22.178 1.00 54.97 ? 146 GLN A CG 1 ATOM 1179 C CD . GLN A 1 146 ? -19.414 70.601 21.154 1.00 68.55 ? 146 GLN A CD 1 ATOM 1180 O OE1 . GLN A 1 146 ? -18.403 70.161 20.585 1.00 58.76 ? 146 GLN A OE1 1 ATOM 1181 N NE2 . GLN A 1 146 ? -20.637 70.129 20.907 1.00 63.26 ? 146 GLN A NE2 1 ATOM 1182 N N . LYS A 1 147 ? -16.076 74.511 22.691 1.00 31.46 ? 147 LYS A N 1 ATOM 1183 C CA . LYS A 1 147 ? -15.930 75.958 22.780 1.00 31.46 ? 147 LYS A CA 1 ATOM 1184 C C . LYS A 1 147 ? -15.063 76.578 21.683 1.00 31.46 ? 147 LYS A C 1 ATOM 1185 O O . LYS A 1 147 ? -15.394 77.651 21.161 1.00 31.46 ? 147 LYS A O 1 ATOM 1186 C CB . LYS A 1 147 ? -15.369 76.357 24.142 1.00 48.72 ? 147 LYS A CB 1 ATOM 1187 C CG . LYS A 1 147 ? -16.279 76.033 25.304 1.00 52.05 ? 147 LYS A CG 1 ATOM 1188 C CD . LYS A 1 147 ? -15.785 76.664 26.604 1.00 60.23 ? 147 LYS A CD 1 ATOM 1189 C CE . LYS A 1 147 ? -16.680 76.262 27.769 1.00 58.71 ? 147 LYS A CE 1 ATOM 1190 N NZ . LYS A 1 147 ? -16.281 76.938 29.030 1.00 74.36 ? 147 LYS A NZ 1 ATOM 1191 N N . TRP A 1 148 ? -13.955 75.927 21.337 1.00 32.34 ? 148 TRP A N 1 ATOM 1192 C CA . TRP A 1 148 ? -13.077 76.468 20.305 1.00 32.34 ? 148 TRP A CA 1 ATOM 1193 C C . TRP A 1 148 ? -13.588 76.205 18.886 1.00 32.34 ? 148 TRP A C 1 ATOM 1194 O O . TRP A 1 148 ? -12.939 76.588 17.908 1.00 32.34 ? 148 TRP A O 1 ATOM 1195 C CB . TRP A 1 148 ? -11.669 75.901 20.439 1.00 26.85 ? 148 TRP A CB 1 ATOM 1196 C CG . TRP A 1 148 ? -10.986 76.242 21.736 1.00 26.85 ? 148 TRP A CG 1 ATOM 1197 C CD1 . TRP A 1 148 ? -11.426 77.110 22.702 1.00 26.85 ? 148 TRP A CD1 1 ATOM 1198 C CD2 . TRP A 1 148 ? -9.713 75.747 22.192 1.00 26.85 ? 148 TRP A CD2 1 ATOM 1199 N NE1 . TRP A 1 148 ? -10.506 77.186 23.721 1.00 26.85 ? 148 TRP A NE1 1 ATOM 1200 C CE2 . TRP A 1 148 ? -9.448 76.362 23.438 1.00 26.85 ? 148 TRP A CE2 1 ATOM 1201 C CE3 . TRP A 1 148 ? -8.773 74.846 21.666 1.00 26.85 ? 148 TRP A CE3 1 ATOM 1202 C CZ2 . TRP A 1 148 ? -8.279 76.106 24.169 1.00 26.85 ? 148 TRP A CZ2 1 ATOM 1203 C CZ3 . TRP A 1 148 ? -7.611 74.593 22.390 1.00 26.85 ? 148 TRP A CZ3 1 ATOM 1204 C CH2 . TRP A 1 148 ? -7.375 75.221 23.629 1.00 26.85 ? 148 TRP A CH2 1 ATOM 1205 N N . GLU A 1 149 ? -14.739 75.553 18.766 1.00 35.00 ? 149 GLU A N 1 ATOM 1206 C CA . GLU A 1 149 ? -15.295 75.274 17.445 1.00 35.00 ? 149 GLU A CA 1 ATOM 1207 C C . GLU A 1 149 ? -16.771 75.665 17.403 1.00 35.00 ? 149 GLU A C 1 ATOM 1208 O O . GLU A 1 149 ? -17.532 75.181 16.566 1.00 35.00 ? 149 GLU A O 1 ATOM 1209 C CB . GLU A 1 149 ? -15.129 73.786 17.096 1.00 28.14 ? 149 GLU A CB 1 ATOM 1210 C CG . GLU A 1 149 ? -13.673 73.331 16.932 1.00 28.14 ? 149 GLU A CG 1 ATOM 1211 C CD . GLU A 1 149 ? -13.559 71.825 16.686 1.00 28.14 ? 149 GLU A CD 1 ATOM 1212 O OE1 . GLU A 1 149 ? -14.585 71.131 16.801 1.00 28.14 ? 149 GLU A OE1 1 ATOM 1213 O OE2 . GLU A 1 149 ? -12.458 71.315 16.391 1.00 28.14 ? 149 GLU A OE2 1 ATOM 1214 N N . ALA A 1 150 ? -17.166 76.556 18.310 1.00 32.90 ? 150 ALA A N 1 ATOM 1215 C CA . ALA A 1 150 ? -18.556 76.988 18.395 1.00 32.90 ? 150 ALA A CA 1 ATOM 1216 C C . ALA A 1 150 ? -19.009 77.830 17.200 1.00 32.90 ? 150 ALA A C 1 ATOM 1217 O O . ALA A 1 150 ? -20.198 78.040 17.002 1.00 32.90 ? 150 ALA A O 1 ATOM 1218 C CB . ALA A 1 150 ? -18.777 77.737 19.689 1.00 23.04 ? 150 ALA A CB 1 ATOM 1219 N N . GLU A 1 151 ? -18.056 78.321 16.418 1.00 36.47 ? 151 GLU A N 1 ATOM 1220 C CA . GLU A 1 151 ? -18.358 79.111 15.222 1.00 36.47 ? 151 GLU A CA 1 ATOM 1221 C C . GLU A 1 151 ? -17.481 78.554 14.094 1.00 36.47 ? 151 GLU A C 1 ATOM 1222 O O . GLU A 1 151 ? -16.305 78.226 14.312 1.00 36.47 ? 151 GLU A O 1 ATOM 1223 C CB . GLU A 1 151 ? -18.024 80.600 15.429 1.00 39.88 ? 151 GLU A CB 1 ATOM 1224 C CG . GLU A 1 151 ? -18.811 81.331 16.515 1.00 50.75 ? 151 GLU A CG 1 ATOM 1225 C CD . GLU A 1 151 ? -20.327 81.258 16.332 1.00 64.55 ? 151 GLU A CD 1 ATOM 1226 O OE1 . GLU A 1 151 ? -20.797 81.227 15.172 1.00 57.03 ? 151 GLU A OE1 1 ATOM 1227 O OE2 . GLU A 1 151 ? -21.052 81.251 17.356 1.00 69.75 ? 151 GLU A OE2 1 ATOM 1228 N N . PRO A 1 152 ? -18.035 78.437 12.878 1.00 40.60 ? 152 PRO A N 1 ATOM 1229 C CA . PRO A 1 152 ? -17.287 77.916 11.726 1.00 42.45 ? 152 PRO A CA 1 ATOM 1230 C C . PRO A 1 152 ? -15.923 78.589 11.498 1.00 40.60 ? 152 PRO A C 1 ATOM 1231 O O . PRO A 1 152 ? -14.964 77.927 11.101 1.00 40.60 ? 152 PRO A O 1 ATOM 1232 C CB . PRO A 1 152 ? -18.245 78.150 10.562 1.00 30.66 ? 152 PRO A CB 1 ATOM 1233 C CG . PRO A 1 152 ? -19.583 77.995 11.199 1.00 30.66 ? 152 PRO A CG 1 ATOM 1234 C CD . PRO A 1 152 ? -19.419 78.761 12.495 1.00 30.66 ? 152 PRO A CD 1 ATOM 1235 N N . VAL A 1 153 ? -15.828 79.892 11.747 1.00 33.68 ? 153 VAL A N 1 ATOM 1236 C CA . VAL A 1 153 ? -14.567 80.592 11.537 1.00 33.68 ? 153 VAL A CA 1 ATOM 1237 C C . VAL A 1 153 ? -13.409 80.032 12.325 1.00 33.68 ? 153 VAL A C 1 ATOM 1238 O O . VAL A 1 153 ? -12.322 79.839 11.783 1.00 33.68 ? 153 VAL A O 1 ATOM 1239 C CB . VAL A 1 153 ? -14.621 82.100 11.923 1.00 38.34 ? 153 VAL A CB 1 ATOM 1240 C CG1 . VAL A 1 153 ? -14.459 82.947 10.693 1.00 50.21 ? 153 VAL A CG1 1 ATOM 1241 C CG2 . VAL A 1 153 ? -15.894 82.425 12.665 1.00 38.34 ? 153 VAL A CG2 1 ATOM 1242 N N . TYR A 1 154 ? -13.648 79.801 13.614 1.00 28.76 ? 154 TYR A N 1 ATOM 1243 C CA . TYR A 1 154 ? -12.620 79.331 14.538 1.00 28.76 ? 154 TYR A CA 1 ATOM 1244 C C . TYR A 1 154 ? -11.595 78.367 13.968 1.00 28.76 ? 154 TYR A C 1 ATOM 1245 O O . TYR A 1 154 ? -10.418 78.725 13.878 1.00 28.76 ? 154 TYR A O 1 ATOM 1246 C CB . TYR A 1 154 ? -13.271 78.752 15.791 1.00 32.34 ? 154 TYR A CB 1 ATOM 1247 C CG . TYR A 1 154 ? -14.099 79.766 16.540 1.00 32.34 ? 154 TYR A CG 1 ATOM 1248 C CD1 . TYR A 1 154 ? -14.067 81.120 16.188 1.00 32.86 ? 154 TYR A CD1 1 ATOM 1249 C CD2 . TYR A 1 154 ? -14.931 79.376 17.585 1.00 32.34 ? 154 TYR A CD2 1 ATOM 1250 C CE1 . TYR A 1 154 ? -14.852 82.060 16.855 1.00 32.34 ? 154 TYR A CE1 1 ATOM 1251 C CE2 . TYR A 1 154 ? -15.719 80.306 18.265 1.00 32.34 ? 154 TYR A CE2 1 ATOM 1252 C CZ . TYR A 1 154 ? -15.676 81.651 17.891 1.00 34.91 ? 154 TYR A CZ 1 ATOM 1253 O OH . TYR A 1 154 ? -16.471 82.573 18.543 1.00 37.64 ? 154 TYR A OH 1 ATOM 1254 N N . VAL A 1 155 ? -12.002 77.161 13.575 1.00 25.42 ? 155 VAL A N 1 ATOM 1255 C CA . VAL A 1 155 ? -11.011 76.261 13.013 1.00 25.42 ? 155 VAL A CA 1 ATOM 1256 C C . VAL A 1 155 ? -10.367 76.910 11.786 1.00 25.42 ? 155 VAL A C 1 ATOM 1257 O O . VAL A 1 155 ? -9.157 76.802 11.606 1.00 25.42 ? 155 VAL A O 1 ATOM 1258 C CB . VAL A 1 155 ? -11.594 74.875 12.650 1.00 25.12 ? 155 VAL A CB 1 ATOM 1259 C CG1 . VAL A 1 155 ? -12.173 74.223 13.896 1.00 25.12 ? 155 VAL A CG1 1 ATOM 1260 C CG2 . VAL A 1 155 ? -12.628 75.004 11.554 1.00 25.12 ? 155 VAL A CG2 1 ATOM 1261 N N . GLN A 1 156 ? -11.153 77.597 10.953 1.00 27.81 ? 156 GLN A N 1 ATOM 1262 C CA . GLN A 1 156 ? -10.589 78.277 9.783 1.00 27.81 ? 156 GLN A CA 1 ATOM 1263 C C . GLN A 1 156 ? -9.449 79.204 10.243 1.00 27.81 ? 156 GLN A C 1 ATOM 1264 O O . GLN A 1 156 ? -8.387 79.255 9.623 1.00 27.81 ? 156 GLN A O 1 ATOM 1265 C CB . GLN A 1 156 ? -11.665 79.086 9.044 1.00 40.01 ? 156 GLN A CB 1 ATOM 1266 C CG . GLN A 1 156 ? -12.767 78.241 8.393 1.00 40.01 ? 156 GLN A CG 1 ATOM 1267 C CD . GLN A 1 156 ? -13.847 79.082 7.694 1.00 52.40 ? 156 GLN A CD 1 ATOM 1268 O OE1 . GLN A 1 156 ? -14.436 79.982 8.293 1.00 44.91 ? 156 GLN A OE1 1 ATOM 1269 N NE2 . GLN A 1 156 ? -14.110 78.781 6.425 1.00 40.01 ? 156 GLN A NE2 1 ATOM 1270 N N . ARG A 1 157 ? -9.670 79.926 11.339 1.00 20.88 ? 157 ARG A N 1 ATOM 1271 C CA . ARG A 1 157 ? -8.650 80.818 11.893 1.00 20.88 ? 157 ARG A CA 1 ATOM 1272 C C . ARG A 1 157 ? -7.424 80.042 12.394 1.00 20.88 ? 157 ARG A C 1 ATOM 1273 O O . ARG A 1 157 ? -6.280 80.427 12.134 1.00 20.88 ? 157 ARG A O 1 ATOM 1274 C CB . ARG A 1 157 ? -9.214 81.625 13.060 1.00 31.81 ? 157 ARG A CB 1 ATOM 1275 C CG . ARG A 1 157 ? -9.891 82.906 12.685 1.00 31.81 ? 157 ARG A CG 1 ATOM 1276 C CD . ARG A 1 157 ? -10.492 83.511 13.924 1.00 31.81 ? 157 ARG A CD 1 ATOM 1277 N NE . ARG A 1 157 ? -11.320 84.681 13.650 1.00 31.81 ? 157 ARG A NE 1 ATOM 1278 C CZ . ARG A 1 157 ? -12.146 85.228 14.537 1.00 38.89 ? 157 ARG A CZ 1 ATOM 1279 N NH1 . ARG A 1 157 ? -12.258 84.699 15.754 1.00 31.81 ? 157 ARG A NH1 1 ATOM 1280 N NH2 . ARG A 1 157 ? -12.843 86.316 14.214 1.00 40.11 ? 157 ARG A NH2 1 ATOM 1281 N N . ALA A 1 158 ? -7.677 78.965 13.132 1.00 26.89 ? 158 ALA A N 1 ATOM 1282 C CA . ALA A 1 158 ? -6.610 78.139 13.660 1.00 26.89 ? 158 ALA A CA 1 ATOM 1283 C C . ALA A 1 158 ? -5.795 77.590 12.493 1.00 26.89 ? 158 ALA A C 1 ATOM 1284 O O . ALA A 1 158 ? -4.559 77.585 12.537 1.00 26.89 ? 158 ALA A O 1 ATOM 1285 C CB . ALA A 1 158 ? -7.192 76.991 14.484 1.00 14.58 ? 158 ALA A CB 1 ATOM 1286 N N . LYS A 1 159 ? -6.472 77.118 11.451 1.00 22.82 ? 159 LYS A N 1 ATOM 1287 C CA . LYS A 1 159 ? -5.743 76.603 10.305 1.00 22.82 ? 159 LYS A CA 1 ATOM 1288 C C . LYS A 1 159 ? -4.941 77.747 9.673 1.00 22.82 ? 159 LYS A C 1 ATOM 1289 O O . LYS A 1 159 ? -3.780 77.563 9.278 1.00 22.82 ? 159 LYS A O 1 ATOM 1290 C CB . LYS A 1 159 ? -6.694 76.003 9.274 1.00 23.15 ? 159 LYS A CB 1 ATOM 1291 C CG . LYS A 1 159 ? -6.015 75.431 8.048 1.00 23.15 ? 159 LYS A CG 1 ATOM 1292 C CD . LYS A 1 159 ? -7.082 75.016 7.043 1.00 23.15 ? 159 LYS A CD 1 ATOM 1293 C CE . LYS A 1 159 ? -6.504 74.574 5.705 1.00 23.15 ? 159 LYS A CE 1 ATOM 1294 N NZ . LYS A 1 159 ? -5.718 73.307 5.802 1.00 25.44 ? 159 LYS A NZ 1 ATOM 1295 N N . ALA A 1 160 ? -5.554 78.927 9.604 1.00 34.44 ? 160 ALA A N 1 ATOM 1296 C CA . ALA A 1 160 ? -4.892 80.088 9.024 1.00 34.44 ? 160 ALA A CA 1 ATOM 1297 C C . ALA A 1 160 ? -3.690 80.522 9.861 1.00 34.44 ? 160 ALA A C 1 ATOM 1298 O O . ALA A 1 160 ? -2.699 81.044 9.330 1.00 34.44 ? 160 ALA A O 1 ATOM 1299 C CB . ALA A 1 160 ? -5.881 81.245 8.880 1.00 6.93 ? 160 ALA A CB 1 ATOM 1300 N N . TYR A 1 161 ? -3.767 80.310 11.171 1.00 23.44 ? 161 TYR A N 1 ATOM 1301 C CA . TYR A 1 161 ? -2.647 80.691 12.027 1.00 23.44 ? 161 TYR A CA 1 ATOM 1302 C C . TYR A 1 161 ? -1.398 79.850 11.744 1.00 23.44 ? 161 TYR A C 1 ATOM 1303 O O . TYR A 1 161 ? -0.307 80.380 11.584 1.00 23.44 ? 161 TYR A O 1 ATOM 1304 C CB . TYR A 1 161 ? -2.998 80.556 13.499 1.00 46.40 ? 161 TYR A CB 1 ATOM 1305 C CG . TYR A 1 161 ? -1.793 80.806 14.350 1.00 46.40 ? 161 TYR A CG 1 ATOM 1306 C CD1 . TYR A 1 161 ? -1.279 82.095 14.506 1.00 48.58 ? 161 TYR A CD1 1 ATOM 1307 C CD2 . TYR A 1 161 ? -1.110 79.744 14.944 1.00 46.40 ? 161 TYR A CD2 1 ATOM 1308 C CE1 . TYR A 1 161 ? -0.113 82.319 15.232 1.00 48.73 ? 161 TYR A CE1 1 ATOM 1309 C CE2 . TYR A 1 161 ? 0.057 79.949 15.667 1.00 46.40 ? 161 TYR A CE2 1 ATOM 1310 C CZ . TYR A 1 161 ? 0.552 81.238 15.810 1.00 49.86 ? 161 TYR A CZ 1 ATOM 1311 O OH . TYR A 1 161 ? 1.708 81.430 16.537 1.00 47.79 ? 161 TYR A OH 1 ATOM 1312 N N . LEU A 1 162 ? -1.566 78.536 11.682 1.00 26.16 ? 162 LEU A N 1 ATOM 1313 C CA . LEU A 1 162 ? -0.443 77.650 11.437 1.00 26.16 ? 162 LEU A CA 1 ATOM 1314 C C . LEU A 1 162 ? 0.029 77.640 9.989 1.00 26.16 ? 162 LEU A C 1 ATOM 1315 O O . LEU A 1 162 ? 1.228 77.520 9.725 1.00 26.16 ? 162 LEU A O 1 ATOM 1316 C CB . LEU A 1 162 ? -0.803 76.222 11.844 1.00 23.05 ? 162 LEU A CB 1 ATOM 1317 C CG . LEU A 1 162 ? -1.163 75.874 13.293 1.00 23.05 ? 162 LEU A CG 1 ATOM 1318 C CD1 . LEU A 1 162 ? -1.464 74.377 13.324 1.00 23.05 ? 162 LEU A CD1 1 ATOM 1319 C CD2 . LEU A 1 162 ? -0.008 76.210 14.259 1.00 23.05 ? 162 LEU A CD2 1 ATOM 1320 N N . GLU A 1 163 ? -0.893 77.768 9.043 1.00 34.17 ? 163 GLU A N 1 ATOM 1321 C CA . GLU A 1 163 ? -0.490 77.732 7.645 1.00 34.17 ? 163 GLU A CA 1 ATOM 1322 C C . GLU A 1 163 ? -0.094 79.061 7.017 1.00 34.17 ? 163 GLU A C 1 ATOM 1323 O O . GLU A 1 163 ? 0.597 79.072 5.993 1.00 34.17 ? 163 GLU A O 1 ATOM 1324 C CB . GLU A 1 163 ? -1.577 77.083 6.802 1.00 44.46 ? 163 GLU A CB 1 ATOM 1325 C CG . GLU A 1 163 ? -1.888 75.670 7.228 1.00 45.07 ? 163 GLU A CG 1 ATOM 1326 C CD . GLU A 1 163 ? -2.895 75.010 6.314 1.00 44.46 ? 163 GLU A CD 1 ATOM 1327 O OE1 . GLU A 1 163 ? -3.727 75.740 5.728 1.00 49.32 ? 163 GLU A OE1 1 ATOM 1328 O OE2 . GLU A 1 163 ? -2.864 73.765 6.194 1.00 49.45 ? 163 GLU A OE2 1 ATOM 1329 N N . GLU A 1 164 ? -0.495 80.176 7.625 1.00 30.20 ? 164 GLU A N 1 ATOM 1330 C CA . GLU A 1 164 ? -0.166 81.471 7.042 1.00 30.20 ? 164 GLU A CA 1 ATOM 1331 C C . GLU A 1 164 ? 0.533 82.477 7.965 1.00 30.20 ? 164 GLU A C 1 ATOM 1332 O O . GLU A 1 164 ? 1.673 82.858 7.713 1.00 30.20 ? 164 GLU A O 1 ATOM 1333 C CB . GLU A 1 164 ? -1.432 82.099 6.443 1.00 36.80 ? 164 GLU A CB 1 ATOM 1334 C CG . GLU A 1 164 ? -2.179 81.185 5.484 1.00 52.59 ? 164 GLU A CG 1 ATOM 1335 C CD . GLU A 1 164 ? -3.395 81.853 4.851 1.00 64.49 ? 164 GLU A CD 1 ATOM 1336 O OE1 . GLU A 1 164 ? -4.212 82.446 5.591 1.00 69.97 ? 164 GLU A OE1 1 ATOM 1337 O OE2 . GLU A 1 164 ? -3.540 81.775 3.609 1.00 75.86 ? 164 GLU A OE2 1 ATOM 1338 N N . GLU A 1 165 ? -0.138 82.913 9.024 1.00 38.09 ? 165 GLU A N 1 ATOM 1339 C CA . GLU A 1 165 ? 0.460 83.882 9.931 1.00 38.09 ? 165 GLU A CA 1 ATOM 1340 C C . GLU A 1 165 ? 1.783 83.435 10.555 1.00 38.09 ? 165 GLU A C 1 ATOM 1341 O O . GLU A 1 165 ? 2.802 84.129 10.439 1.00 38.09 ? 165 GLU A O 1 ATOM 1342 C CB . GLU A 1 165 ? -0.529 84.240 11.030 1.00 49.42 ? 165 GLU A CB 1 ATOM 1343 C CG . GLU A 1 165 ? -1.710 85.041 10.523 1.00 65.43 ? 165 GLU A CG 1 ATOM 1344 C CD . GLU A 1 165 ? -2.931 84.914 11.412 1.00 71.29 ? 165 GLU A CD 1 ATOM 1345 O OE1 . GLU A 1 165 ? -2.826 85.223 12.621 1.00 77.93 ? 165 GLU A OE1 1 ATOM 1346 O OE2 . GLU A 1 165 ? -3.994 84.501 10.897 1.00 74.33 ? 165 GLU A OE2 1 ATOM 1347 N N . CYS A 1 166 ? 1.783 82.275 11.204 1.00 41.74 ? 166 CYS A N 1 ATOM 1348 C CA . CYS A 1 166 ? 2.997 81.807 11.852 1.00 41.74 ? 166 CYS A CA 1 ATOM 1349 C C . CYS A 1 166 ? 4.180 81.783 10.883 1.00 41.74 ? 166 CYS A C 1 ATOM 1350 O O . CYS A 1 166 ? 5.209 82.415 11.144 1.00 41.74 ? 166 CYS A O 1 ATOM 1351 C CB . CYS A 1 166 ? 2.778 80.432 12.493 1.00 42.78 ? 166 CYS A CB 1 ATOM 1352 S SG . CYS A 1 166 ? 3.868 80.137 13.917 1.00 42.79 ? 166 CYS A SG 1 ATOM 1353 N N . PRO A 1 167 ? 4.060 81.057 9.758 1.00 41.00 ? 167 PRO A N 1 ATOM 1354 C CA . PRO A 1 167 ? 5.189 81.039 8.820 1.00 41.00 ? 167 PRO A CA 1 ATOM 1355 C C . PRO A 1 167 ? 5.530 82.432 8.271 1.00 41.00 ? 167 PRO A C 1 ATOM 1356 O O . PRO A 1 167 ? 6.661 82.675 7.836 1.00 41.00 ? 167 PRO A O 1 ATOM 1357 C CB . PRO A 1 167 ? 4.732 80.056 7.734 1.00 23.89 ? 167 PRO A CB 1 ATOM 1358 C CG . PRO A 1 167 ? 3.250 80.084 7.829 1.00 26.62 ? 167 PRO A CG 1 ATOM 1359 C CD . PRO A 1 167 ? 2.998 80.136 9.313 1.00 23.89 ? 167 PRO A CD 1 ATOM 1360 N N . ALA A 1 168 ? 4.567 83.350 8.292 1.00 42.01 ? 168 ALA A N 1 ATOM 1361 C CA . ALA A 1 168 ? 4.843 84.708 7.820 1.00 42.01 ? 168 ALA A CA 1 ATOM 1362 C C . ALA A 1 168 ? 5.696 85.399 8.896 1.00 43.51 ? 168 ALA A C 1 ATOM 1363 O O . ALA A 1 168 ? 6.672 86.087 8.583 1.00 42.01 ? 168 ALA A O 1 ATOM 1364 C CB . ALA A 1 168 ? 3.530 85.481 7.590 1.00 17.02 ? 168 ALA A CB 1 ATOM 1365 N N . THR A 1 169 ? 5.319 85.202 10.161 1.00 26.41 ? 169 THR A N 1 ATOM 1366 C CA . THR A 1 169 ? 6.054 85.763 11.280 1.00 26.41 ? 169 THR A CA 1 ATOM 1367 C C . THR A 1 169 ? 7.480 85.214 11.267 1.00 26.41 ? 169 THR A C 1 ATOM 1368 O O . THR A 1 169 ? 8.446 85.960 11.471 1.00 26.41 ? 169 THR A O 1 ATOM 1369 C CB . THR A 1 169 ? 5.403 85.390 12.623 1.00 21.42 ? 169 THR A CB 1 ATOM 1370 O OG1 . THR A 1 169 ? 4.059 85.891 12.659 1.00 21.42 ? 169 THR A OG1 1 ATOM 1371 C CG2 . THR A 1 169 ? 6.192 85.982 13.786 1.00 21.42 ? 169 THR A CG2 1 ATOM 1372 N N . LEU A 1 170 ? 7.614 83.911 11.031 1.00 48.50 ? 170 LEU A N 1 ATOM 1373 C CA . LEU A 1 170 ? 8.934 83.293 10.988 1.00 48.50 ? 170 LEU A CA 1 ATOM 1374 C C . LEU A 1 170 ? 9.796 83.907 9.884 1.00 50.51 ? 170 LEU A C 1 ATOM 1375 O O . LEU A 1 170 ? 10.967 84.213 10.104 1.00 48.50 ? 170 LEU A O 1 ATOM 1376 C CB . LEU A 1 170 ? 8.826 81.780 10.764 1.00 33.19 ? 170 LEU A CB 1 ATOM 1377 C CG . LEU A 1 170 ? 10.175 81.069 10.571 1.00 33.19 ? 170 LEU A CG 1 ATOM 1378 C CD1 . LEU A 1 170 ? 11.116 81.399 11.730 1.00 33.19 ? 170 LEU A CD1 1 ATOM 1379 C CD2 . LEU A 1 170 ? 9.960 79.571 10.473 1.00 33.19 ? 170 LEU A CD2 1 ATOM 1380 N N . ARG A 1 171 ? 9.222 84.082 8.698 1.00 49.01 ? 171 ARG A N 1 ATOM 1381 C CA . ARG A 1 171 ? 9.970 84.671 7.593 1.00 49.01 ? 171 ARG A CA 1 ATOM 1382 C C . ARG A 1 171 ? 10.345 86.110 7.932 1.00 49.01 ? 171 ARG A C 1 ATOM 1383 O O . ARG A 1 171 ? 11.476 86.540 7.700 1.00 54.65 ? 171 ARG A O 1 ATOM 1384 C CB . ARG A 1 171 ? 9.150 84.647 6.307 1.00 31.05 ? 171 ARG A CB 1 ATOM 1385 C CG . ARG A 1 171 ? 8.965 83.270 5.699 1.00 31.05 ? 171 ARG A CG 1 ATOM 1386 C CD . ARG A 1 171 ? 8.213 83.422 4.392 1.00 34.44 ? 171 ARG A CD 1 ATOM 1387 N NE . ARG A 1 171 ? 7.449 82.232 4.023 1.00 48.69 ? 171 ARG A NE 1 ATOM 1388 C CZ . ARG A 1 171 ? 7.981 81.151 3.470 1.00 38.97 ? 171 ARG A CZ 1 ATOM 1389 N NH1 . ARG A 1 171 ? 9.284 81.116 3.222 1.00 55.57 ? 171 ARG A NH1 1 ATOM 1390 N NH2 . ARG A 1 171 ? 7.209 80.113 3.173 1.00 42.53 ? 171 ARG A NH2 1 ATOM 1391 N N . LYS A 1 172 ? 9.398 86.858 8.482 1.00 38.09 ? 172 LYS A N 1 ATOM 1392 C CA . LYS A 1 172 ? 9.685 88.231 8.847 1.00 38.09 ? 172 LYS A CA 1 ATOM 1393 C C . LYS A 1 172 ? 10.899 88.249 9.769 1.00 46.86 ? 172 LYS A C 1 ATOM 1394 O O . LYS A 1 172 ? 11.848 88.996 9.542 1.00 39.46 ? 172 LYS A O 1 ATOM 1395 C CB . LYS A 1 172 ? 8.490 88.859 9.562 1.00 37.25 ? 172 LYS A CB 1 ATOM 1396 C CG . LYS A 1 172 ? 8.737 90.283 10.035 1.00 42.74 ? 172 LYS A CG 1 ATOM 1397 C CD . LYS A 1 172 ? 7.567 90.800 10.863 1.00 54.32 ? 172 LYS A CD 1 ATOM 1398 C CE . LYS A 1 172 ? 7.857 92.178 11.435 1.00 62.60 ? 172 LYS A CE 1 ATOM 1399 N NZ . LYS A 1 172 ? 6.891 92.534 12.513 1.00 66.22 ? 172 LYS A NZ 1 ATOM 1400 N N . TYR A 1 173 ? 10.869 87.410 10.802 1.00 45.56 ? 173 TYR A N 1 ATOM 1401 C CA . TYR A 1 173 ? 11.964 87.347 11.757 1.00 45.34 ? 173 TYR A CA 1 ATOM 1402 C C . TYR A 1 173 ? 13.285 86.922 11.134 1.00 47.05 ? 173 TYR A C 1 ATOM 1403 O O . TYR A 1 173 ? 14.340 87.420 11.521 1.00 50.23 ? 173 TYR A O 1 ATOM 1404 C CB . TYR A 1 173 ? 11.629 86.395 12.907 1.00 34.98 ? 173 TYR A CB 1 ATOM 1405 C CG . TYR A 1 173 ? 10.522 86.859 13.833 1.00 34.98 ? 173 TYR A CG 1 ATOM 1406 C CD1 . TYR A 1 173 ? 10.041 88.168 13.792 1.00 34.98 ? 173 TYR A CD1 1 ATOM 1407 C CD2 . TYR A 1 173 ? 9.988 85.994 14.783 1.00 34.98 ? 173 TYR A CD2 1 ATOM 1408 C CE1 . TYR A 1 173 ? 9.060 88.600 14.675 1.00 34.98 ? 173 TYR A CE1 1 ATOM 1409 C CE2 . TYR A 1 173 ? 9.012 86.415 15.672 1.00 34.98 ? 173 TYR A CE2 1 ATOM 1410 C CZ . TYR A 1 173 ? 8.550 87.718 15.616 1.00 34.98 ? 173 TYR A CZ 1 ATOM 1411 O OH . TYR A 1 173 ? 7.580 88.126 16.511 1.00 34.98 ? 173 TYR A OH 1 ATOM 1412 N N . LEU A 1 174 ? 13.251 85.997 10.185 1.00 39.92 ? 174 LEU A N 1 ATOM 1413 C CA . LEU A 1 174 ? 14.498 85.575 9.569 1.00 44.58 ? 174 LEU A CA 1 ATOM 1414 C C . LEU A 1 174 ? 15.144 86.771 8.865 1.00 48.77 ? 174 LEU A C 1 ATOM 1415 O O . LEU A 1 174 ? 16.377 86.880 8.797 1.00 47.17 ? 174 LEU A O 1 ATOM 1416 C CB . LEU A 1 174 ? 14.255 84.434 8.580 1.00 31.87 ? 174 LEU A CB 1 ATOM 1417 C CG . LEU A 1 174 ? 13.733 83.125 9.186 1.00 41.36 ? 174 LEU A CG 1 ATOM 1418 C CD1 . LEU A 1 174 ? 13.837 82.014 8.156 1.00 41.20 ? 174 LEU A CD1 1 ATOM 1419 C CD2 . LEU A 1 174 ? 14.549 82.744 10.431 1.00 34.02 ? 174 LEU A CD2 1 ATOM 1420 N N . LYS A 1 175 ? 14.313 87.680 8.358 1.00 39.46 ? 175 LYS A N 1 ATOM 1421 C CA . LYS A 1 175 ? 14.834 88.857 7.682 1.00 49.99 ? 175 LYS A CA 1 ATOM 1422 C C . LYS A 1 175 ? 15.683 89.697 8.619 1.00 48.15 ? 175 LYS A C 1 ATOM 1423 O O . LYS A 1 175 ? 16.684 90.270 8.201 1.00 49.67 ? 175 LYS A O 1 ATOM 1424 C CB . LYS A 1 175 ? 13.702 89.713 7.112 1.00 53.19 ? 175 LYS A CB 1 ATOM 1425 C CG . LYS A 1 175 ? 13.232 89.252 5.749 1.00 62.95 ? 175 LYS A CG 1 ATOM 1426 C CD . LYS A 1 175 ? 12.355 90.296 5.077 1.00 72.90 ? 175 LYS A CD 1 ATOM 1427 C CE . LYS A 1 175 ? 12.078 89.917 3.627 1.00 78.65 ? 175 LYS A CE 1 ATOM 1428 N NZ . LYS A 1 175 ? 11.274 90.948 2.916 1.00 82.05 ? 175 LYS A NZ 1 ATOM 1429 N N . TYR A 1 176 ? 15.288 89.768 9.885 1.00 50.47 ? 176 TYR A N 1 ATOM 1430 C CA . TYR A 1 176 ? 16.039 90.545 10.868 1.00 48.43 ? 176 TYR A CA 1 ATOM 1431 C C . TYR A 1 176 ? 17.009 89.712 11.696 1.00 47.50 ? 176 TYR A C 1 ATOM 1432 O O . TYR A 1 176 ? 17.695 90.253 12.557 1.00 48.09 ? 176 TYR A O 1 ATOM 1433 C CB . TYR A 1 176 ? 15.091 91.247 11.840 1.00 46.54 ? 176 TYR A CB 1 ATOM 1434 C CG . TYR A 1 176 ? 14.198 92.293 11.221 1.00 63.71 ? 176 TYR A CG 1 ATOM 1435 C CD1 . TYR A 1 176 ? 13.184 91.937 10.330 1.00 63.50 ? 176 TYR A CD1 1 ATOM 1436 C CD2 . TYR A 1 176 ? 14.341 93.641 11.556 1.00 62.41 ? 176 TYR A CD2 1 ATOM 1437 C CE1 . TYR A 1 176 ? 12.328 92.900 9.795 1.00 67.01 ? 176 TYR A CE1 1 ATOM 1438 C CE2 . TYR A 1 176 ? 13.493 94.610 11.025 1.00 63.70 ? 176 TYR A CE2 1 ATOM 1439 C CZ . TYR A 1 176 ? 12.487 94.233 10.150 1.00 65.91 ? 176 TYR A CZ 1 ATOM 1440 O OH . TYR A 1 176 ? 11.623 95.183 9.657 1.00 65.73 ? 176 TYR A OH 1 ATOM 1441 N N . SER A 1 177 ? 17.087 88.409 11.447 1.00 45.50 ? 177 SER A N 1 ATOM 1442 C CA . SER A 1 177 ? 17.952 87.571 12.262 1.00 45.50 ? 177 SER A CA 1 ATOM 1443 C C . SER A 1 177 ? 19.102 86.867 11.577 1.00 53.89 ? 177 SER A C 1 ATOM 1444 O O . SER A 1 177 ? 19.741 86.007 12.181 1.00 52.96 ? 177 SER A O 1 ATOM 1445 C CB . SER A 1 177 ? 17.102 86.545 13.001 1.00 36.54 ? 177 SER A CB 1 ATOM 1446 O OG . SER A 1 177 ? 16.124 87.198 13.791 1.00 29.00 ? 177 SER A OG 1 ATOM 1447 N N . LYS A 1 178 ? 19.373 87.222 10.328 1.00 45.66 ? 178 LYS A N 1 ATOM 1448 C CA . LYS A 1 178 ? 20.481 86.619 9.604 1.00 49.20 ? 178 LYS A CA 1 ATOM 1449 C C . LYS A 1 178 ? 21.742 86.741 10.466 1.00 43.96 ? 178 LYS A C 1 ATOM 1450 O O . LYS A 1 178 ? 22.458 85.760 10.696 1.00 53.37 ? 178 LYS A O 1 ATOM 1451 C CB . LYS A 1 178 ? 20.705 87.352 8.278 1.00 70.98 ? 178 LYS A CB 1 ATOM 1452 C CG . LYS A 1 178 ? 19.557 87.268 7.287 1.00 76.29 ? 178 LYS A CG 1 ATOM 1453 C CD . LYS A 1 178 ? 19.811 88.197 6.100 1.00 80.80 ? 178 LYS A CD 1 ATOM 1454 C CE . LYS A 1 178 ? 18.796 88.002 4.977 1.00 86.08 ? 178 LYS A CE 1 ATOM 1455 N NZ . LYS A 1 178 ? 18.980 86.705 4.261 1.00 87.18 ? 178 LYS A NZ 1 ATOM 1456 N N . ASN A 1 179 ? 22.001 87.957 10.944 1.00 69.76 ? 179 ASN A N 1 ATOM 1457 C CA . ASN A 1 179 ? 23.169 88.228 11.772 1.00 75.75 ? 179 ASN A CA 1 ATOM 1458 C C . ASN A 1 179 ? 23.121 87.502 13.097 1.00 77.80 ? 179 ASN A C 1 ATOM 1459 O O . ASN A 1 179 ? 23.987 87.711 13.948 1.00 76.28 ? 179 ASN A O 1 ATOM 1460 C CB . ASN A 1 179 ? 23.315 89.727 12.037 1.00 84.17 ? 179 ASN A CB 1 ATOM 1461 C CG . ASN A 1 179 ? 23.721 90.494 10.801 1.00 98.50 ? 179 ASN A CG 1 ATOM 1462 O OD1 . ASN A 1 179 ? 24.665 90.116 10.105 1.00 105.03 ? 179 ASN A OD1 1 ATOM 1463 N ND2 . ASN A 1 179 ? 23.017 91.584 10.520 1.00 97.23 ? 179 ASN A ND2 1 ATOM 1464 N N . ILE A 1 180 ? 22.108 86.660 13.281 1.00 56.08 ? 180 ILE A N 1 ATOM 1465 C CA . ILE A 1 180 ? 21.992 85.906 14.520 1.00 48.68 ? 180 ILE A CA 1 ATOM 1466 C C . ILE A 1 180 ? 21.932 84.395 14.321 1.00 47.29 ? 180 ILE A C 1 ATOM 1467 O O . ILE A 1 180 ? 22.730 83.659 14.899 1.00 47.87 ? 180 ILE A O 1 ATOM 1468 C CB . ILE A 1 180 ? 20.766 86.332 15.343 1.00 26.45 ? 180 ILE A CB 1 ATOM 1469 C CG1 . ILE A 1 180 ? 20.811 87.843 15.611 1.00 24.03 ? 180 ILE A CG1 1 ATOM 1470 C CG2 . ILE A 1 180 ? 20.754 85.552 16.671 1.00 24.03 ? 180 ILE A CG2 1 ATOM 1471 C CD1 . ILE A 1 180 ? 19.734 88.341 16.574 1.00 24.03 ? 180 ILE A CD1 1 ATOM 1472 N N . LEU A 1 181 ? 20.996 83.927 13.507 1.00 42.29 ? 181 LEU A N 1 ATOM 1473 C CA . LEU A 1 181 ? 20.867 82.491 13.287 1.00 42.29 ? 181 LEU A CA 1 ATOM 1474 C C . LEU A 1 181 ? 21.823 81.925 12.247 1.00 42.78 ? 181 LEU A C 1 ATOM 1475 O O . LEU A 1 181 ? 22.104 80.728 12.249 1.00 42.29 ? 181 LEU A O 1 ATOM 1476 C CB . LEU A 1 181 ? 19.438 82.152 12.877 1.00 34.41 ? 181 LEU A CB 1 ATOM 1477 C CG . LEU A 1 181 ? 18.360 82.594 13.859 1.00 34.41 ? 181 LEU A CG 1 ATOM 1478 C CD1 . LEU A 1 181 ? 17.000 82.341 13.243 1.00 34.58 ? 181 LEU A CD1 1 ATOM 1479 C CD2 . LEU A 1 181 ? 18.515 81.841 15.183 1.00 34.41 ? 181 LEU A CD2 1 ATOM 1480 N N . ASP A 1 182 ? 22.321 82.770 11.353 1.00 46.88 ? 182 ASP A N 1 ATOM 1481 C CA . ASP A 1 182 ? 23.223 82.281 10.318 1.00 50.02 ? 182 ASP A CA 1 ATOM 1482 C C . ASP A 1 182 ? 24.693 82.475 10.633 1.00 53.70 ? 182 ASP A C 1 ATOM 1483 O O . ASP A 1 182 ? 25.541 82.221 9.786 1.00 52.41 ? 182 ASP A O 1 ATOM 1484 C CB . ASP A 1 182 ? 22.898 82.931 8.970 1.00 59.63 ? 182 ASP A CB 1 ATOM 1485 C CG . ASP A 1 182 ? 21.518 82.556 8.458 1.00 72.56 ? 182 ASP A CG 1 ATOM 1486 O OD1 . ASP A 1 182 ? 21.180 81.353 8.495 1.00 73.17 ? 182 ASP A OD1 1 ATOM 1487 O OD2 . ASP A 1 182 ? 20.775 83.457 8.009 1.00 76.83 ? 182 ASP A OD2 1 ATOM 1488 N N . ARG A 1 183 ? 25.001 82.911 11.850 1.00 40.58 ? 183 ARG A N 1 ATOM 1489 C CA . ARG A 1 183 ? 26.390 83.119 12.231 1.00 41.27 ? 183 ARG A CA 1 ATOM 1490 C C . ARG A 1 183 ? 27.216 81.853 12.151 1.00 40.55 ? 183 ARG A C 1 ATOM 1491 O O . ARG A 1 183 ? 26.704 80.732 12.203 1.00 37.85 ? 183 ARG A O 1 ATOM 1492 C CB . ARG A 1 183 ? 26.503 83.644 13.658 1.00 40.32 ? 183 ARG A CB 1 ATOM 1493 C CG . ARG A 1 183 ? 25.879 84.980 13.880 1.00 42.22 ? 183 ARG A CG 1 ATOM 1494 C CD . ARG A 1 183 ? 25.109 84.943 15.162 1.00 58.96 ? 183 ARG A CD 1 ATOM 1495 N NE . ARG A 1 183 ? 25.963 84.716 16.314 1.00 58.79 ? 183 ARG A NE 1 ATOM 1496 C CZ . ARG A 1 183 ? 25.592 84.014 17.377 1.00 51.28 ? 183 ARG A CZ 1 ATOM 1497 N NH1 . ARG A 1 183 ? 24.388 83.458 17.423 1.00 40.32 ? 183 ARG A NH1 1 ATOM 1498 N NH2 . ARG A 1 183 ? 26.411 83.904 18.412 1.00 40.32 ? 183 ARG A NH2 1 ATOM 1499 N N . GLN A 1 184 ? 28.518 82.064 12.042 1.00 56.88 ? 184 GLN A N 1 ATOM 1500 C CA . GLN A 1 184 ? 29.484 80.996 11.990 1.00 56.63 ? 184 GLN A CA 1 ATOM 1501 C C . GLN A 1 184 ? 30.666 81.506 12.782 1.00 59.86 ? 184 GLN A C 1 ATOM 1502 O O . GLN A 1 184 ? 31.792 81.512 12.304 1.00 60.19 ? 184 GLN A O 1 ATOM 1503 C CB . GLN A 1 184 ? 29.870 80.703 10.548 1.00 39.50 ? 184 GLN A CB 1 ATOM 1504 C CG . GLN A 1 184 ? 28.875 79.800 9.858 1.00 44.23 ? 184 GLN A CG 1 ATOM 1505 C CD . GLN A 1 184 ? 28.910 78.386 10.412 1.00 44.90 ? 184 GLN A CD 1 ATOM 1506 O OE1 . GLN A 1 184 ? 27.968 77.612 10.242 1.00 47.89 ? 184 GLN A OE1 1 ATOM 1507 N NE2 . GLN A 1 184 ? 30.013 78.038 11.066 1.00 37.10 ? 184 GLN A NE2 1 ATOM 1508 N N . ASP A 1 185 ? 30.386 81.961 13.998 1.00 40.41 ? 185 ASP A N 1 ATOM 1509 C CA . ASP A 1 185 ? 31.421 82.477 14.878 1.00 40.41 ? 185 ASP A CA 1 ATOM 1510 C C . ASP A 1 185 ? 32.405 81.384 15.265 1.00 44.35 ? 185 ASP A C 1 ATOM 1511 O O . ASP A 1 185 ? 32.049 80.429 15.956 1.00 41.10 ? 185 ASP A O 1 ATOM 1512 C CB . ASP A 1 185 ? 30.787 83.076 16.124 1.00 51.85 ? 185 ASP A CB 1 ATOM 1513 C CG . ASP A 1 185 ? 29.940 84.286 15.805 1.00 58.72 ? 185 ASP A CG 1 ATOM 1514 O OD1 . ASP A 1 185 ? 30.055 84.786 14.664 1.00 62.45 ? 185 ASP A OD1 1 ATOM 1515 O OD2 . ASP A 1 185 ? 29.175 84.739 16.685 1.00 59.92 ? 185 ASP A OD2 1 ATOM 1516 N N . PRO A 1 186 ? 33.663 81.506 14.808 1.00 45.29 ? 186 PRO A N 1 ATOM 1517 C CA . PRO A 1 186 ? 34.708 80.523 15.104 1.00 45.29 ? 186 PRO A CA 1 ATOM 1518 C C . PRO A 1 186 ? 35.034 80.470 16.591 1.00 45.29 ? 186 PRO A C 1 ATOM 1519 O O . PRO A 1 186 ? 35.064 81.495 17.280 1.00 45.29 ? 186 PRO A O 1 ATOM 1520 C CB . PRO A 1 186 ? 35.876 81.003 14.252 1.00 40.50 ? 186 PRO A CB 1 ATOM 1521 C CG . PRO A 1 186 ? 35.689 82.479 14.272 1.00 41.30 ? 186 PRO A CG 1 ATOM 1522 C CD . PRO A 1 186 ? 34.213 82.632 14.038 1.00 39.45 ? 186 PRO A CD 1 ATOM 1523 N N . PRO A 1 187 ? 35.297 79.267 17.104 1.00 40.15 ? 187 PRO A N 1 ATOM 1524 C CA . PRO A 1 187 ? 35.612 79.080 18.518 1.00 39.51 ? 187 PRO A CA 1 ATOM 1525 C C . PRO A 1 187 ? 36.991 79.550 18.928 1.00 39.63 ? 187 PRO A C 1 ATOM 1526 O O . PRO A 1 187 ? 37.974 79.314 18.224 1.00 39.51 ? 187 PRO A O 1 ATOM 1527 C CB . PRO A 1 187 ? 35.475 77.578 18.691 1.00 34.97 ? 187 PRO A CB 1 ATOM 1528 C CG . PRO A 1 187 ? 36.063 77.080 17.411 1.00 36.94 ? 187 PRO A CG 1 ATOM 1529 C CD . PRO A 1 187 ? 35.417 77.992 16.374 1.00 34.97 ? 187 PRO A CD 1 ATOM 1530 N N . SER A 1 188 ? 37.047 80.228 20.069 1.00 40.40 ? 188 SER A N 1 ATOM 1531 C CA . SER A 1 188 ? 38.307 80.676 20.642 1.00 42.27 ? 188 SER A CA 1 ATOM 1532 C C . SER A 1 188 ? 38.596 79.532 21.613 1.00 48.72 ? 188 SER A C 1 ATOM 1533 O O . SER A 1 188 ? 37.688 79.064 22.300 1.00 41.31 ? 188 SER A O 1 ATOM 1534 C CB . SER A 1 188 ? 38.123 81.984 21.417 1.00 39.00 ? 188 SER A CB 1 ATOM 1535 O OG . SER A 1 188 ? 37.670 83.021 20.571 1.00 50.37 ? 188 SER A OG 1 ATOM 1536 N N . VAL A 1 189 ? 39.830 79.049 21.658 1.00 45.92 ? 189 VAL A N 1 ATOM 1537 C CA . VAL A 1 189 ? 40.129 77.959 22.576 1.00 52.15 ? 189 VAL A CA 1 ATOM 1538 C C . VAL A 1 189 ? 41.160 78.371 23.606 1.00 57.11 ? 189 VAL A C 1 ATOM 1539 O O . VAL A 1 189 ? 41.915 79.315 23.405 1.00 56.97 ? 189 VAL A O 1 ATOM 1540 C CB . VAL A 1 189 ? 40.625 76.693 21.832 1.00 40.11 ? 189 VAL A CB 1 ATOM 1541 C CG1 . VAL A 1 189 ? 40.198 76.755 20.368 1.00 35.18 ? 189 VAL A CG1 1 ATOM 1542 C CG2 . VAL A 1 189 ? 42.127 76.544 21.984 1.00 55.96 ? 189 VAL A CG2 1 ATOM 1543 N N . VAL A 1 190 ? 41.176 77.653 24.718 1.00 49.25 ? 190 VAL A N 1 ATOM 1544 C CA . VAL A 1 190 ? 42.106 77.931 25.801 1.00 47.17 ? 190 VAL A CA 1 ATOM 1545 C C . VAL A 1 190 ? 42.438 76.650 26.551 1.00 55.03 ? 190 VAL A C 1 ATOM 1546 O O . VAL A 1 190 ? 41.556 76.018 27.134 1.00 47.75 ? 190 VAL A O 1 ATOM 1547 C CB . VAL A 1 190 ? 41.515 78.933 26.803 1.00 53.00 ? 190 VAL A CB 1 ATOM 1548 C CG1 . VAL A 1 190 ? 42.450 79.094 27.980 1.00 48.39 ? 190 VAL A CG1 1 ATOM 1549 C CG2 . VAL A 1 190 ? 41.295 80.268 26.130 1.00 63.33 ? 190 VAL A CG2 1 ATOM 1550 N N . VAL A 1 191 ? 43.708 76.261 26.516 1.00 47.80 ? 191 VAL A N 1 ATOM 1551 C CA . VAL A 1 191 ? 44.157 75.070 27.218 1.00 45.07 ? 191 VAL A CA 1 ATOM 1552 C C . VAL A 1 191 ? 44.668 75.527 28.572 1.00 47.08 ? 191 VAL A C 1 ATOM 1553 O O . VAL A 1 191 ? 45.378 76.519 28.677 1.00 44.69 ? 191 VAL A O 1 ATOM 1554 C CB . VAL A 1 191 ? 45.270 74.353 26.447 1.00 57.88 ? 191 VAL A CB 1 ATOM 1555 C CG1 . VAL A 1 191 ? 45.993 73.393 27.359 1.00 59.99 ? 191 VAL A CG1 1 ATOM 1556 C CG2 . VAL A 1 191 ? 44.669 73.587 25.275 1.00 49.64 ? 191 VAL A CG2 1 ATOM 1557 N N . THR A 1 192 ? 44.286 74.820 29.621 1.00 67.57 ? 192 THR A N 1 ATOM 1558 C CA . THR A 1 192 ? 44.716 75.208 30.952 1.00 63.43 ? 192 THR A CA 1 ATOM 1559 C C . THR A 1 192 ? 44.895 73.956 31.799 1.00 65.77 ? 192 THR A C 1 ATOM 1560 O O . THR A 1 192 ? 44.304 72.915 31.510 1.00 67.22 ? 192 THR A O 1 ATOM 1561 C CB . THR A 1 192 ? 43.682 76.167 31.584 1.00 47.11 ? 192 THR A CB 1 ATOM 1562 O OG1 . THR A 1 192 ? 44.228 76.740 32.774 1.00 64.20 ? 192 THR A OG1 1 ATOM 1563 C CG2 . THR A 1 192 ? 42.389 75.428 31.913 1.00 42.29 ? 192 THR A CG2 1 ATOM 1564 N N . SER A 1 193 ? 45.719 74.048 32.837 1.00 58.24 ? 193 SER A N 1 ATOM 1565 C CA . SER A 1 193 ? 45.976 72.890 33.685 1.00 62.92 ? 193 SER A CA 1 ATOM 1566 C C . SER A 1 193 ? 45.818 73.193 35.162 1.00 61.87 ? 193 SER A C 1 ATOM 1567 O O . SER A 1 193 ? 45.973 74.335 35.594 1.00 57.30 ? 193 SER A O 1 ATOM 1568 C CB . SER A 1 193 ? 47.391 72.360 33.439 1.00 107.92 ? 193 SER A CB 1 ATOM 1569 O OG . SER A 1 193 ? 48.369 73.306 33.839 1.00 111.25 ? 193 SER A OG 1 ATOM 1570 N N . HIS A 1 194 ? 45.499 72.160 35.934 1.00 74.56 ? 194 HIS A N 1 ATOM 1571 C CA . HIS A 1 194 ? 45.350 72.322 37.369 1.00 80.22 ? 194 HIS A CA 1 ATOM 1572 C C . HIS A 1 194 ? 45.825 71.073 38.094 1.00 78.60 ? 194 HIS A C 1 ATOM 1573 O O . HIS A 1 194 ? 45.581 69.944 37.650 1.00 67.00 ? 194 HIS A O 1 ATOM 1574 C CB . HIS A 1 194 ? 43.901 72.620 37.740 1.00 97.40 ? 194 HIS A CB 1 ATOM 1575 C CG . HIS A 1 194 ? 43.758 73.282 39.073 1.00 108.71 ? 194 HIS A CG 1 ATOM 1576 N ND1 . HIS A 1 194 ? 44.252 72.728 40.234 1.00 112.47 ? 194 HIS A ND1 1 ATOM 1577 C CD2 . HIS A 1 194 ? 43.215 74.472 39.425 1.00 112.41 ? 194 HIS A CD2 1 ATOM 1578 C CE1 . HIS A 1 194 ? 44.022 73.548 41.243 1.00 117.60 ? 194 HIS A CE1 1 ATOM 1579 N NE2 . HIS A 1 194 ? 43.394 74.614 40.779 1.00 116.56 ? 194 HIS A NE2 1 ATOM 1580 N N . GLN A 1 195 ? 46.514 71.292 39.208 1.00 111.37 ? 195 GLN A N 1 ATOM 1581 C CA . GLN A 1 195 ? 47.054 70.208 40.015 1.00 121.38 ? 195 GLN A CA 1 ATOM 1582 C C . GLN A 1 195 ? 46.367 70.163 41.373 1.00 123.99 ? 195 GLN A C 1 ATOM 1583 O O . GLN A 1 195 ? 46.558 71.050 42.206 1.00 120.76 ? 195 GLN A O 1 ATOM 1584 C CB . GLN A 1 195 ? 48.561 70.406 40.213 1.00 92.93 ? 195 GLN A CB 1 ATOM 1585 C CG . GLN A 1 195 ? 49.267 69.247 40.899 1.00 93.44 ? 195 GLN A CG 1 ATOM 1586 C CD . GLN A 1 195 ? 49.281 67.998 40.046 1.00 95.79 ? 195 GLN A CD 1 ATOM 1587 O OE1 . GLN A 1 195 ? 48.231 67.497 39.648 1.00 99.19 ? 195 GLN A OE1 1 ATOM 1588 N NE2 . GLN A 1 195 ? 50.473 67.488 39.760 1.00 92.57 ? 195 GLN A NE2 1 ATOM 1589 N N . ALA A 1 196 ? 45.563 69.129 41.587 1.00 138.74 ? 196 ALA A N 1 ATOM 1590 C CA . ALA A 1 196 ? 44.858 68.966 42.850 1.00 143.23 ? 196 ALA A CA 1 ATOM 1591 C C . ALA A 1 196 ? 45.798 68.318 43.858 1.00 144.63 ? 196 ALA A C 1 ATOM 1592 O O . ALA A 1 196 ? 46.329 67.235 43.612 1.00 144.97 ? 196 ALA A O 1 ATOM 1593 C CB . ALA A 1 196 ? 43.625 68.096 42.653 1.00 108.85 ? 196 ALA A CB 1 ATOM 1594 N N . PRO A 1 197 ? 46.021 68.976 45.006 1.00 117.56 ? 197 PRO A N 1 ATOM 1595 C CA . PRO A 1 197 ? 46.913 68.422 46.030 1.00 117.56 ? 197 PRO A CA 1 ATOM 1596 C C . PRO A 1 197 ? 46.600 66.963 46.366 1.00 117.19 ? 197 PRO A C 1 ATOM 1597 O O . PRO A 1 197 ? 45.631 66.665 47.065 1.00 119.19 ? 197 PRO A O 1 ATOM 1598 C CB . PRO A 1 197 ? 46.707 69.367 47.219 1.00 108.54 ? 197 PRO A CB 1 ATOM 1599 C CG . PRO A 1 197 ? 45.327 69.929 46.990 1.00 110.45 ? 197 PRO A CG 1 ATOM 1600 C CD . PRO A 1 197 ? 45.331 70.176 45.508 1.00 112.22 ? 197 PRO A CD 1 ATOM 1601 N N . GLY A 1 198 ? 47.430 66.061 45.852 1.00 94.79 ? 198 GLY A N 1 ATOM 1602 C CA . GLY A 1 198 ? 47.235 64.644 46.093 1.00 91.76 ? 198 GLY A CA 1 ATOM 1603 C C . GLY A 1 198 ? 46.782 63.899 44.850 1.00 92.82 ? 198 GLY A C 1 ATOM 1604 O O . GLY A 1 198 ? 46.937 62.682 44.760 1.00 93.78 ? 198 GLY A O 1 ATOM 1605 N N . GLU A 1 199 ? 46.230 64.631 43.887 1.00 128.38 ? 199 GLU A N 1 ATOM 1606 C CA . GLU A 1 199 ? 45.741 64.034 42.645 1.00 125.51 ? 199 GLU A CA 1 ATOM 1607 C C . GLU A 1 199 ? 46.661 64.312 41.457 1.00 122.01 ? 199 GLU A C 1 ATOM 1608 O O . GLU A 1 199 ? 47.640 65.047 41.575 1.00 117.32 ? 199 GLU A O 1 ATOM 1609 C CB . GLU A 1 199 ? 44.344 64.568 42.327 1.00 106.14 ? 199 GLU A CB 1 ATOM 1610 C CG . GLU A 1 199 ? 43.339 64.394 43.447 1.00 108.55 ? 199 GLU A CG 1 ATOM 1611 C CD . GLU A 1 199 ? 41.993 64.997 43.107 1.00 110.02 ? 199 GLU A CD 1 ATOM 1612 O OE1 . GLU A 1 199 ? 41.391 64.569 42.098 1.00 111.22 ? 199 GLU A OE1 1 ATOM 1613 O OE2 . GLU A 1 199 ? 41.539 65.898 43.845 1.00 109.33 ? 199 GLU A OE2 1 ATOM 1614 N N . LYS A 1 200 ? 46.334 63.718 40.313 1.00 92.69 ? 200 LYS A N 1 ATOM 1615 C CA . LYS A 1 200 ? 47.117 63.905 39.097 1.00 89.90 ? 200 LYS A CA 1 ATOM 1616 C C . LYS A 1 200 ? 46.893 65.304 38.532 1.00 91.23 ? 200 LYS A C 1 ATOM 1617 O O . LYS A 1 200 ? 46.006 66.036 38.979 1.00 90.76 ? 200 LYS A O 1 ATOM 1618 C CB . LYS A 1 200 ? 46.709 62.891 38.028 1.00 72.25 ? 200 LYS A CB 1 ATOM 1619 C CG . LYS A 1 200 ? 46.834 61.439 38.425 1.00 71.17 ? 200 LYS A CG 1 ATOM 1620 C CD . LYS A 1 200 ? 46.410 60.548 37.262 1.00 67.56 ? 200 LYS A CD 1 ATOM 1621 C CE . LYS A 1 200 ? 46.442 59.070 37.632 1.00 78.23 ? 200 LYS A CE 1 ATOM 1622 N NZ . LYS A 1 200 ? 47.807 58.601 38.011 1.00 78.85 ? 200 LYS A NZ 1 ATOM 1623 N N . LYS A 1 201 ? 47.708 65.672 37.548 1.00 120.86 ? 201 LYS A N 1 ATOM 1624 C CA . LYS A 1 201 ? 47.574 66.968 36.900 1.00 117.19 ? 201 LYS A CA 1 ATOM 1625 C C . LYS A 1 201 ? 46.505 66.799 35.837 1.00 113.71 ? 201 LYS A C 1 ATOM 1626 O O . LYS A 1 201 ? 46.464 65.779 35.147 1.00 109.93 ? 201 LYS A O 1 ATOM 1627 C CB . LYS A 1 201 ? 48.888 67.389 36.237 1.00 114.39 ? 201 LYS A CB 1 ATOM 1628 C CG . LYS A 1 201 ? 48.772 68.659 35.400 1.00 115.95 ? 201 LYS A CG 1 ATOM 1629 C CD . LYS A 1 201 ? 50.042 68.940 34.611 1.00 116.19 ? 201 LYS A CD 1 ATOM 1630 C CE . LYS A 1 201 ? 51.225 69.211 35.524 1.00 118.40 ? 201 LYS A CE 1 ATOM 1631 N NZ . LYS A 1 201 ? 52.470 69.457 34.748 1.00 120.16 ? 201 LYS A NZ 1 ATOM 1632 N N . LYS A 1 202 ? 45.634 67.790 35.707 1.00 81.87 ? 202 LYS A N 1 ATOM 1633 C CA . LYS A 1 202 ? 44.573 67.712 34.716 1.00 80.33 ? 202 LYS A CA 1 ATOM 1634 C C . LYS A 1 202 ? 44.614 68.888 33.748 1.00 75.08 ? 202 LYS A C 1 ATOM 1635 O O . LYS A 1 202 ? 44.836 70.035 34.145 1.00 66.36 ? 202 LYS A O 1 ATOM 1636 C CB . LYS A 1 202 ? 43.221 67.618 35.427 1.00 91.52 ? 202 LYS A CB 1 ATOM 1637 C CG . LYS A 1 202 ? 43.099 66.341 36.249 1.00 97.10 ? 202 LYS A CG 1 ATOM 1638 C CD . LYS A 1 202 ? 41.902 66.350 37.175 1.00 105.02 ? 202 LYS A CD 1 ATOM 1639 C CE . LYS A 1 202 ? 41.878 65.092 38.023 1.00 105.03 ? 202 LYS A CE 1 ATOM 1640 N NZ . LYS A 1 202 ? 40.760 65.102 38.999 1.00 110.88 ? 202 LYS A NZ 1 ATOM 1641 N N . LEU A 1 203 ? 44.418 68.577 32.470 1.00 67.18 ? 203 LEU A N 1 ATOM 1642 C CA . LEU A 1 203 ? 44.443 69.575 31.412 1.00 69.63 ? 203 LEU A CA 1 ATOM 1643 C C . LEU A 1 203 ? 43.039 69.815 30.881 1.00 66.63 ? 203 LEU A C 1 ATOM 1644 O O . LEU A 1 203 ? 42.349 68.871 30.483 1.00 62.20 ? 203 LEU A O 1 ATOM 1645 C CB . LEU A 1 203 ? 45.346 69.106 30.267 1.00 51.63 ? 203 LEU A CB 1 ATOM 1646 C CG . LEU A 1 203 ? 46.768 68.657 30.617 1.00 55.09 ? 203 LEU A CG 1 ATOM 1647 C CD1 . LEU A 1 203 ? 47.519 68.385 29.328 1.00 51.69 ? 203 LEU A CD1 1 ATOM 1648 C CD2 . LEU A 1 203 ? 47.480 69.719 31.446 1.00 48.76 ? 203 LEU A CD2 1 ATOM 1649 N N . LYS A 1 204 ? 42.637 71.084 30.860 1.00 60.21 ? 204 LYS A N 1 ATOM 1650 C CA . LYS A 1 204 ? 41.311 71.473 30.393 1.00 56.70 ? 204 LYS A CA 1 ATOM 1651 C C . LYS A 1 204 ? 41.304 72.313 29.113 1.00 59.46 ? 204 LYS A C 1 ATOM 1652 O O . LYS A 1 204 ? 41.776 73.453 29.098 1.00 60.50 ? 204 LYS A O 1 ATOM 1653 C CB . LYS A 1 204 ? 40.583 72.242 31.504 1.00 49.14 ? 204 LYS A CB 1 ATOM 1654 C CG . LYS A 1 204 ? 39.214 72.788 31.115 1.00 56.98 ? 204 LYS A CG 1 ATOM 1655 C CD . LYS A 1 204 ? 38.696 73.681 32.222 1.00 60.95 ? 204 LYS A CD 1 ATOM 1656 C CE . LYS A 1 204 ? 37.416 74.379 31.822 1.00 75.86 ? 204 LYS A CE 1 ATOM 1657 N NZ . LYS A 1 204 ? 36.924 75.236 32.935 1.00 73.64 ? 204 LYS A NZ 1 ATOM 1658 N N . CYS A 1 205 ? 40.754 71.739 28.047 1.00 47.11 ? 205 CYS A N 1 ATOM 1659 C CA . CYS A 1 205 ? 40.643 72.429 26.771 1.00 46.98 ? 205 CYS A CA 1 ATOM 1660 C C . CYS A 1 205 ? 39.275 73.105 26.670 1.00 47.09 ? 205 CYS A C 1 ATOM 1661 O O . CYS A 1 205 ? 38.239 72.437 26.719 1.00 46.17 ? 205 CYS A O 1 ATOM 1662 C CB . CYS A 1 205 ? 40.771 71.453 25.612 1.00 64.51 ? 205 CYS A CB 1 ATOM 1663 S SG . CYS A 1 205 ? 40.844 72.354 24.033 1.00 84.44 ? 205 CYS A SG 1 ATOM 1664 N N . LEU A 1 206 ? 39.263 74.420 26.494 1.00 51.03 ? 206 LEU A N 1 ATOM 1665 C CA . LEU A 1 206 ? 37.998 75.128 26.415 1.00 46.79 ? 206 LEU A CA 1 ATOM 1666 C C . LEU A 1 206 ? 37.770 75.858 25.103 1.00 54.36 ? 206 LEU A C 1 ATOM 1667 O O . LEU A 1 206 ? 38.579 76.684 24.705 1.00 48.00 ? 206 LEU A O 1 ATOM 1668 C CB . LEU A 1 206 ? 37.895 76.133 27.565 1.00 32.65 ? 206 LEU A CB 1 ATOM 1669 C CG . LEU A 1 206 ? 36.615 76.978 27.584 1.00 35.49 ? 206 LEU A CG 1 ATOM 1670 C CD1 . LEU A 1 206 ? 35.431 76.096 27.942 1.00 44.66 ? 206 LEU A CD1 1 ATOM 1671 C CD2 . LEU A 1 206 ? 36.746 78.111 28.584 1.00 35.81 ? 206 LEU A CD2 1 ATOM 1672 N N . ALA A 1 207 ? 36.663 75.544 24.436 1.00 39.17 ? 207 ALA A N 1 ATOM 1673 C CA . ALA A 1 207 ? 36.285 76.210 23.186 1.00 39.17 ? 207 ALA A CA 1 ATOM 1674 C C . ALA A 1 207 ? 35.151 77.154 23.577 1.00 41.98 ? 207 ALA A C 1 ATOM 1675 O O . ALA A 1 207 ? 34.203 76.738 24.234 1.00 42.49 ? 207 ALA A O 1 ATOM 1676 C CB . ALA A 1 207 ? 35.793 75.196 22.165 1.00 21.72 ? 207 ALA A CB 1 ATOM 1677 N N . TYR A 1 208 ? 35.240 78.424 23.202 1.00 35.83 ? 208 TYR A N 1 ATOM 1678 C CA . TYR A 1 208 ? 34.184 79.355 23.578 1.00 35.83 ? 208 TYR A CA 1 ATOM 1679 C C . TYR A 1 208 ? 33.886 80.432 22.548 1.00 35.83 ? 208 TYR A C 1 ATOM 1680 O O . TYR A 1 208 ? 34.607 80.597 21.569 1.00 35.83 ? 208 TYR A O 1 ATOM 1681 C CB . TYR A 1 208 ? 34.512 80.015 24.918 1.00 43.20 ? 208 TYR A CB 1 ATOM 1682 C CG . TYR A 1 208 ? 35.780 80.841 24.907 1.00 45.79 ? 208 TYR A CG 1 ATOM 1683 C CD1 . TYR A 1 208 ? 37.028 80.241 24.761 1.00 51.59 ? 208 TYR A CD1 1 ATOM 1684 C CD2 . TYR A 1 208 ? 35.731 82.227 25.051 1.00 48.93 ? 208 TYR A CD2 1 ATOM 1685 C CE1 . TYR A 1 208 ? 38.197 81.003 24.759 1.00 53.18 ? 208 TYR A CE1 1 ATOM 1686 C CE2 . TYR A 1 208 ? 36.890 82.994 25.053 1.00 47.25 ? 208 TYR A CE2 1 ATOM 1687 C CZ . TYR A 1 208 ? 38.121 82.378 24.906 1.00 61.34 ? 208 TYR A CZ 1 ATOM 1688 O OH . TYR A 1 208 ? 39.270 83.139 24.910 1.00 69.46 ? 208 TYR A OH 1 ATOM 1689 N N . ASP A 1 209 ? 32.799 81.155 22.790 1.00 38.04 ? 209 ASP A N 1 ATOM 1690 C CA . ASP A 1 209 ? 32.349 82.223 21.918 1.00 40.49 ? 209 ASP A CA 1 ATOM 1691 C C . ASP A 1 209 ? 32.008 81.734 20.527 1.00 44.74 ? 209 ASP A C 1 ATOM 1692 O O . ASP A 1 209 ? 32.031 82.516 19.591 1.00 40.98 ? 209 ASP A O 1 ATOM 1693 C CB . ASP A 1 209 ? 33.410 83.327 21.814 1.00 51.49 ? 209 ASP A CB 1 ATOM 1694 C CG . ASP A 1 209 ? 33.501 84.187 23.071 1.00 53.52 ? 209 ASP A CG 1 ATOM 1695 O OD1 . ASP A 1 209 ? 32.660 84.024 23.988 1.00 52.07 ? 209 ASP A OD1 1 ATOM 1696 O OD2 . ASP A 1 209 ? 34.415 85.038 23.135 1.00 60.33 ? 209 ASP A OD2 1 ATOM 1697 N N . PHE A 1 210 ? 31.671 80.458 20.377 1.00 38.68 ? 210 PHE A N 1 ATOM 1698 C CA . PHE A 1 210 ? 31.355 79.932 19.046 1.00 38.68 ? 210 PHE A CA 1 ATOM 1699 C C . PHE A 1 210 ? 29.874 79.612 18.779 1.00 38.68 ? 210 PHE A C 1 ATOM 1700 O O . PHE A 1 210 ? 29.084 79.403 19.705 1.00 38.68 ? 210 PHE A O 1 ATOM 1701 C CB . PHE A 1 210 ? 32.187 78.681 18.781 1.00 42.32 ? 210 PHE A CB 1 ATOM 1702 C CG . PHE A 1 210 ? 31.799 77.505 19.628 1.00 47.48 ? 210 PHE A CG 1 ATOM 1703 C CD1 . PHE A 1 210 ? 30.849 76.592 19.178 1.00 42.32 ? 210 PHE A CD1 1 ATOM 1704 C CD2 . PHE A 1 210 ? 32.389 77.306 20.876 1.00 42.32 ? 210 PHE A CD2 1 ATOM 1705 C CE1 . PHE A 1 210 ? 30.497 75.495 19.955 1.00 42.32 ? 210 PHE A CE1 1 ATOM 1706 C CE2 . PHE A 1 210 ? 32.043 76.213 21.664 1.00 44.51 ? 210 PHE A CE2 1 ATOM 1707 C CZ . PHE A 1 210 ? 31.098 75.305 21.204 1.00 42.32 ? 210 PHE A CZ 1 ATOM 1708 N N . TYR A 1 211 ? 29.518 79.573 17.497 1.00 42.05 ? 211 TYR A N 1 ATOM 1709 C CA . TYR A 1 211 ? 28.161 79.266 17.068 1.00 42.05 ? 211 TYR A CA 1 ATOM 1710 C C . TYR A 1 211 ? 28.230 78.854 15.599 1.00 42.05 ? 211 TYR A C 1 ATOM 1711 O O . TYR A 1 211 ? 28.979 79.454 14.830 1.00 42.77 ? 211 TYR A O 1 ATOM 1712 C CB . TYR A 1 211 ? 27.269 80.493 17.209 1.00 39.15 ? 211 TYR A CB 1 ATOM 1713 C CG . TYR A 1 211 ? 25.811 80.202 16.957 1.00 39.15 ? 211 TYR A CG 1 ATOM 1714 C CD1 . TYR A 1 211 ? 24.959 79.838 18.004 1.00 39.15 ? 211 TYR A CD1 1 ATOM 1715 C CD2 . TYR A 1 211 ? 25.273 80.283 15.669 1.00 39.15 ? 211 TYR A CD2 1 ATOM 1716 C CE1 . TYR A 1 211 ? 23.597 79.566 17.774 1.00 39.15 ? 211 TYR A CE1 1 ATOM 1717 C CE2 . TYR A 1 211 ? 23.919 80.014 15.430 1.00 39.49 ? 211 TYR A CE2 1 ATOM 1718 C CZ . TYR A 1 211 ? 23.086 79.661 16.487 1.00 39.15 ? 211 TYR A CZ 1 ATOM 1719 O OH . TYR A 1 211 ? 21.745 79.433 16.261 1.00 39.15 ? 211 TYR A OH 1 ATOM 1720 N N . PRO A 1 212 ? 27.460 77.825 15.182 1.00 42.08 ? 212 PRO A N 1 ATOM 1721 C CA . PRO A 1 212 ? 26.509 76.973 15.909 1.00 42.08 ? 212 PRO A CA 1 ATOM 1722 C C . PRO A 1 212 ? 27.146 76.084 16.968 1.00 42.08 ? 212 PRO A C 1 ATOM 1723 O O . PRO A 1 212 ? 28.366 75.933 17.017 1.00 42.08 ? 212 PRO A O 1 ATOM 1724 C CB . PRO A 1 212 ? 25.868 76.143 14.801 1.00 36.96 ? 212 PRO A CB 1 ATOM 1725 C CG . PRO A 1 212 ? 26.056 76.987 13.565 1.00 46.56 ? 212 PRO A CG 1 ATOM 1726 C CD . PRO A 1 212 ? 27.460 77.467 13.753 1.00 36.96 ? 212 PRO A CD 1 ATOM 1727 N N . GLY A 1 213 ? 26.293 75.483 17.794 1.00 36.65 ? 213 GLY A N 1 ATOM 1728 C CA . GLY A 1 213 ? 26.729 74.617 18.885 1.00 36.65 ? 213 GLY A CA 1 ATOM 1729 C C . GLY A 1 213 ? 27.465 73.344 18.517 1.00 36.65 ? 213 GLY A C 1 ATOM 1730 O O . GLY A 1 213 ? 28.357 72.928 19.240 1.00 36.81 ? 213 GLY A O 1 ATOM 1731 N N . LYS A 1 214 ? 27.093 72.717 17.410 1.00 42.84 ? 214 LYS A N 1 ATOM 1732 C CA . LYS A 1 214 ? 27.754 71.491 16.972 1.00 43.25 ? 214 LYS A CA 1 ATOM 1733 C C . LYS A 1 214 ? 29.273 71.711 16.892 1.00 46.24 ? 214 LYS A C 1 ATOM 1734 O O . LYS A 1 214 ? 29.750 72.523 16.093 1.00 42.84 ? 214 LYS A O 1 ATOM 1735 C CB . LYS A 1 214 ? 27.211 71.090 15.599 1.00 70.06 ? 214 LYS A CB 1 ATOM 1736 C CG . LYS A 1 214 ? 27.908 69.921 14.928 1.00 85.20 ? 214 LYS A CG 1 ATOM 1737 C CD . LYS A 1 214 ? 27.529 68.596 15.552 1.00 97.53 ? 214 LYS A CD 1 ATOM 1738 C CE . LYS A 1 214 ? 27.995 67.442 14.676 1.00 102.36 ? 214 LYS A CE 1 ATOM 1739 N NZ . LYS A 1 214 ? 27.382 67.507 13.317 1.00 109.70 ? 214 LYS A NZ 1 ATOM 1740 N N . ILE A 1 215 ? 30.035 70.995 17.717 1.00 51.38 ? 215 ILE A N 1 ATOM 1741 C CA . ILE A 1 215 ? 31.487 71.150 17.713 1.00 54.37 ? 215 ILE A CA 1 ATOM 1742 C C . ILE A 1 215 ? 32.187 69.854 18.103 1.00 61.89 ? 215 ILE A C 1 ATOM 1743 O O . ILE A 1 215 ? 31.597 68.996 18.752 1.00 53.30 ? 215 ILE A O 1 ATOM 1744 C CB . ILE A 1 215 ? 31.927 72.267 18.699 1.00 44.04 ? 215 ILE A CB 1 ATOM 1745 C CG1 . ILE A 1 215 ? 33.333 72.771 18.339 1.00 48.39 ? 215 ILE A CG1 1 ATOM 1746 C CG2 . ILE A 1 215 ? 31.937 71.735 20.137 1.00 45.34 ? 215 ILE A CG2 1 ATOM 1747 C CD1 . ILE A 1 215 ? 33.793 73.979 19.175 1.00 44.04 ? 215 ILE A CD1 1 ATOM 1748 N N . ASP A 1 216 ? 33.446 69.718 17.701 1.00 51.30 ? 216 ASP A N 1 ATOM 1749 C CA . ASP A 1 216 ? 34.235 68.534 18.029 1.00 45.60 ? 216 ASP A CA 1 ATOM 1750 C C . ASP A 1 216 ? 35.482 68.966 18.796 1.00 52.29 ? 216 ASP A C 1 ATOM 1751 O O . ASP A 1 216 ? 36.346 69.656 18.254 1.00 52.18 ? 216 ASP A O 1 ATOM 1752 C CB . ASP A 1 216 ? 34.650 67.792 16.759 1.00 85.00 ? 216 ASP A CB 1 ATOM 1753 C CG . ASP A 1 216 ? 35.360 66.487 17.057 1.00 102.13 ? 216 ASP A CG 1 ATOM 1754 O OD1 . ASP A 1 216 ? 36.349 66.506 17.821 1.00 104.41 ? 216 ASP A OD1 1 ATOM 1755 O OD2 . ASP A 1 216 ? 34.930 65.440 16.527 1.00 107.14 ? 216 ASP A OD2 1 ATOM 1756 N N . VAL A 1 217 ? 35.576 68.560 20.058 1.00 44.63 ? 217 VAL A N 1 ATOM 1757 C CA . VAL A 1 217 ? 36.719 68.924 20.886 1.00 52.71 ? 217 VAL A CA 1 ATOM 1758 C C . VAL A 1 217 ? 37.324 67.694 21.545 1.00 61.61 ? 217 VAL A C 1 ATOM 1759 O O . VAL A 1 217 ? 36.627 66.959 22.240 1.00 60.84 ? 217 VAL A O 1 ATOM 1760 C CB . VAL A 1 217 ? 36.311 69.900 22.007 1.00 51.65 ? 217 VAL A CB 1 ATOM 1761 C CG1 . VAL A 1 217 ? 37.552 70.424 22.702 1.00 52.75 ? 217 VAL A CG1 1 ATOM 1762 C CG2 . VAL A 1 217 ? 35.481 71.043 21.443 1.00 52.77 ? 217 VAL A CG2 1 ATOM 1763 N N . HIS A 1 218 ? 38.617 67.470 21.337 1.00 66.27 ? 218 HIS A N 1 ATOM 1764 C CA . HIS A 1 218 ? 39.275 66.321 21.945 1.00 69.94 ? 218 HIS A CA 1 ATOM 1765 C C . HIS A 1 218 ? 40.777 66.502 22.119 1.00 72.37 ? 218 HIS A C 1 ATOM 1766 O O . HIS A 1 218 ? 41.414 67.235 21.366 1.00 72.12 ? 218 HIS A O 1 ATOM 1767 C CB . HIS A 1 218 ? 39.023 65.060 21.119 1.00 70.40 ? 218 HIS A CB 1 ATOM 1768 C CG . HIS A 1 218 ? 39.729 65.052 19.801 1.00 76.84 ? 218 HIS A CG 1 ATOM 1769 N ND1 . HIS A 1 218 ? 39.221 65.672 18.679 1.00 78.61 ? 218 HIS A ND1 1 ATOM 1770 C CD2 . HIS A 1 218 ? 40.915 64.513 19.429 1.00 80.30 ? 218 HIS A CD2 1 ATOM 1771 C CE1 . HIS A 1 218 ? 40.063 65.513 17.673 1.00 74.53 ? 218 HIS A CE1 1 ATOM 1772 N NE2 . HIS A 1 218 ? 41.099 64.813 18.102 1.00 81.19 ? 218 HIS A NE2 1 ATOM 1773 N N . TRP A 1 219 ? 41.332 65.825 23.120 1.00 73.22 ? 219 TRP A N 1 ATOM 1774 C CA . TRP A 1 219 ? 42.762 65.881 23.388 1.00 72.17 ? 219 TRP A CA 1 ATOM 1775 C C . TRP A 1 219 ? 43.499 64.794 22.611 1.00 74.98 ? 219 TRP A C 1 ATOM 1776 O O . TRP A 1 219 ? 42.879 63.909 22.016 1.00 75.81 ? 219 TRP A O 1 ATOM 1777 C CB . TRP A 1 219 ? 43.052 65.676 24.874 1.00 58.55 ? 219 TRP A CB 1 ATOM 1778 C CG . TRP A 1 219 ? 42.878 66.884 25.729 1.00 61.54 ? 219 TRP A CG 1 ATOM 1779 C CD1 . TRP A 1 219 ? 41.804 67.182 26.518 1.00 53.63 ? 219 TRP A CD1 1 ATOM 1780 C CD2 . TRP A 1 219 ? 43.834 67.936 25.937 1.00 60.84 ? 219 TRP A CD2 1 ATOM 1781 N NE1 . TRP A 1 219 ? 42.034 68.352 27.214 1.00 58.17 ? 219 TRP A NE1 1 ATOM 1782 C CE2 . TRP A 1 219 ? 43.271 68.835 26.876 1.00 58.81 ? 219 TRP A CE2 1 ATOM 1783 C CE3 . TRP A 1 219 ? 45.111 68.205 25.425 1.00 65.13 ? 219 TRP A CE3 1 ATOM 1784 C CZ2 . TRP A 1 219 ? 43.943 69.982 27.313 1.00 63.37 ? 219 TRP A CZ2 1 ATOM 1785 C CZ3 . TRP A 1 219 ? 45.778 69.348 25.862 1.00 55.25 ? 219 TRP A CZ3 1 ATOM 1786 C CH2 . TRP A 1 219 ? 45.190 70.220 26.798 1.00 59.91 ? 219 TRP A CH2 1 ATOM 1787 N N . THR A 1 220 ? 44.827 64.880 22.619 1.00 89.91 ? 220 THR A N 1 ATOM 1788 C CA . THR A 1 220 ? 45.687 63.903 21.958 1.00 91.82 ? 220 THR A CA 1 ATOM 1789 C C . THR A 1 220 ? 46.973 63.773 22.763 1.00 93.75 ? 220 THR A C 1 ATOM 1790 O O . THR A 1 220 ? 47.614 64.770 23.100 1.00 91.24 ? 220 THR A O 1 ATOM 1791 C CB . THR A 1 220 ? 46.049 64.309 20.506 1.00 94.49 ? 220 THR A CB 1 ATOM 1792 O OG1 . THR A 1 220 ? 46.680 65.596 20.505 1.00 95.51 ? 220 THR A OG1 1 ATOM 1793 C CG2 . THR A 1 220 ? 44.803 64.339 19.633 1.00 99.43 ? 220 THR A CG2 1 ATOM 1794 N N . ARG A 1 221 ? 47.327 62.537 23.092 1.00 88.79 ? 221 ARG A N 1 ATOM 1795 C CA . ARG A 1 221 ? 48.535 62.255 23.852 1.00 91.59 ? 221 ARG A CA 1 ATOM 1796 C C . ARG A 1 221 ? 49.492 61.607 22.867 1.00 92.14 ? 221 ARG A C 1 ATOM 1797 O O . ARG A 1 221 ? 49.402 60.408 22.592 1.00 91.96 ? 221 ARG A O 1 ATOM 1798 C CB . ARG A 1 221 ? 48.211 61.302 25.007 1.00 102.15 ? 221 ARG A CB 1 ATOM 1799 C CG . ARG A 1 221 ? 49.329 61.093 26.010 1.00 105.26 ? 221 ARG A CG 1 ATOM 1800 C CD . ARG A 1 221 ? 50.035 59.767 25.797 1.00 107.81 ? 221 ARG A CD 1 ATOM 1801 N NE . ARG A 1 221 ? 51.061 59.541 26.811 1.00 104.86 ? 221 ARG A NE 1 ATOM 1802 C CZ . ARG A 1 221 ? 51.856 58.476 26.853 1.00 104.55 ? 221 ARG A CZ 1 ATOM 1803 N NH1 . ARG A 1 221 ? 51.747 57.527 25.934 1.00 104.55 ? 221 ARG A NH1 1 ATOM 1804 N NH2 . ARG A 1 221 ? 52.763 58.362 27.814 1.00 106.15 ? 221 ARG A NH2 1 ATOM 1805 N N . ALA A 1 222 ? 50.393 62.419 22.322 1.00 73.15 ? 222 ALA A N 1 ATOM 1806 C CA . ALA A 1 222 ? 51.361 61.946 21.344 1.00 73.50 ? 222 ALA A CA 1 ATOM 1807 C C . ALA A 1 222 ? 50.620 61.500 20.087 1.00 72.30 ? 222 ALA A C 1 ATOM 1808 O O . ALA A 1 222 ? 50.747 60.356 19.650 1.00 72.77 ? 222 ALA A O 1 ATOM 1809 C CB . ALA A 1 222 ? 52.170 60.792 21.921 1.00 92.59 ? 222 ALA A CB 1 ATOM 1810 N N . GLY A 1 223 ? 49.836 62.414 19.519 1.00 90.62 ? 223 GLY A N 1 ATOM 1811 C CA . GLY A 1 223 ? 49.081 62.110 18.316 1.00 89.46 ? 223 GLY A CA 1 ATOM 1812 C C . GLY A 1 223 ? 48.002 61.065 18.524 1.00 94.01 ? 223 GLY A C 1 ATOM 1813 O O . GLY A 1 223 ? 47.370 60.624 17.565 1.00 94.75 ? 223 GLY A O 1 ATOM 1814 N N . GLU A 1 224 ? 47.787 60.668 19.775 1.00 99.07 ? 224 GLU A N 1 ATOM 1815 C CA . GLU A 1 224 ? 46.778 59.665 20.107 1.00 102.36 ? 224 GLU A CA 1 ATOM 1816 C C . GLU A 1 224 ? 45.585 60.286 20.822 1.00 98.10 ? 224 GLU A C 1 ATOM 1817 O O . GLU A 1 224 ? 45.720 60.808 21.929 1.00 94.31 ? 224 GLU A O 1 ATOM 1818 C CB . GLU A 1 224 ? 47.387 58.577 20.998 1.00 106.24 ? 224 GLU A CB 1 ATOM 1819 C CG . GLU A 1 224 ? 48.405 57.688 20.304 1.00 113.30 ? 224 GLU A CG 1 ATOM 1820 C CD . GLU A 1 224 ? 47.778 56.790 19.252 1.00 115.70 ? 224 GLU A CD 1 ATOM 1821 O OE1 . GLU A 1 224 ? 46.907 55.972 19.613 1.00 116.39 ? 224 GLU A OE1 1 ATOM 1822 O OE2 . GLU A 1 224 ? 48.156 56.901 18.066 1.00 113.74 ? 224 GLU A OE2 1 ATOM 1823 N N . VAL A 1 225 ? 44.417 60.224 20.188 1.00 92.22 ? 225 VAL A N 1 ATOM 1824 C CA . VAL A 1 225 ? 43.202 60.776 20.780 1.00 93.32 ? 225 VAL A CA 1 ATOM 1825 C C . VAL A 1 225 ? 42.908 60.093 22.117 1.00 89.32 ? 225 VAL A C 1 ATOM 1826 O O . VAL A 1 225 ? 42.756 58.875 22.189 1.00 87.59 ? 225 VAL A O 1 ATOM 1827 C CB . VAL A 1 225 ? 41.992 60.610 19.828 1.00 92.07 ? 225 VAL A CB 1 ATOM 1828 C CG1 . VAL A 1 225 ? 41.883 59.169 19.363 1.00 96.43 ? 225 VAL A CG1 1 ATOM 1829 C CG2 . VAL A 1 225 ? 40.718 61.044 20.531 1.00 88.25 ? 225 VAL A CG2 1 ATOM 1830 N N . GLN A 1 226 ? 42.830 60.894 23.174 1.00 65.03 ? 226 GLN A N 1 ATOM 1831 C CA . GLN A 1 226 ? 42.585 60.380 24.517 1.00 67.33 ? 226 GLN A CA 1 ATOM 1832 C C . GLN A 1 226 ? 41.124 60.315 24.918 1.00 71.78 ? 226 GLN A C 1 ATOM 1833 O O . GLN A 1 226 ? 40.265 60.982 24.340 1.00 74.33 ? 226 GLN A O 1 ATOM 1834 C CB . GLN A 1 226 ? 43.328 61.233 25.547 1.00 87.83 ? 226 GLN A CB 1 ATOM 1835 C CG . GLN A 1 226 ? 44.814 61.306 25.307 1.00 91.66 ? 226 GLN A CG 1 ATOM 1836 C CD . GLN A 1 226 ? 45.462 59.944 25.344 1.00 85.74 ? 226 GLN A CD 1 ATOM 1837 O OE1 . GLN A 1 226 ? 45.632 59.354 26.413 1.00 85.72 ? 226 GLN A OE1 1 ATOM 1838 N NE2 . GLN A 1 226 ? 45.818 59.429 24.173 1.00 80.32 ? 226 GLN A NE2 1 ATOM 1839 N N . GLU A 1 227 ? 40.855 59.494 25.925 1.00 87.30 ? 227 GLU A N 1 ATOM 1840 C CA . GLU A 1 227 ? 39.512 59.347 26.451 1.00 82.20 ? 227 GLU A CA 1 ATOM 1841 C C . GLU A 1 227 ? 39.390 60.427 27.515 1.00 73.34 ? 227 GLU A C 1 ATOM 1842 O O . GLU A 1 227 ? 40.123 60.426 28.502 1.00 73.27 ? 227 GLU A O 1 ATOM 1843 C CB . GLU A 1 227 ? 39.335 57.962 27.074 1.00 116.96 ? 227 GLU A CB 1 ATOM 1844 C CG . GLU A 1 227 ? 37.953 57.725 27.648 1.00 128.60 ? 227 GLU A CG 1 ATOM 1845 C CD . GLU A 1 227 ? 36.858 58.004 26.642 1.00 133.76 ? 227 GLU A CD 1 ATOM 1846 O OE1 . GLU A 1 227 ? 36.852 57.359 25.572 1.00 134.85 ? 227 GLU A OE1 1 ATOM 1847 O OE2 . GLU A 1 227 ? 36.004 58.872 26.922 1.00 137.62 ? 227 GLU A OE2 1 ATOM 1848 N N . PRO A 1 228 ? 38.469 61.377 27.322 1.00 57.35 ? 228 PRO A N 1 ATOM 1849 C CA . PRO A 1 228 ? 38.302 62.450 28.302 1.00 56.16 ? 228 PRO A CA 1 ATOM 1850 C C . PRO A 1 228 ? 37.866 61.965 29.676 1.00 56.78 ? 228 PRO A C 1 ATOM 1851 O O . PRO A 1 228 ? 37.095 61.020 29.793 1.00 56.86 ? 228 PRO A O 1 ATOM 1852 C CB . PRO A 1 228 ? 37.260 63.351 27.645 1.00 53.70 ? 228 PRO A CB 1 ATOM 1853 C CG . PRO A 1 228 ? 36.427 62.380 26.867 1.00 49.14 ? 228 PRO A CG 1 ATOM 1854 C CD . PRO A 1 228 ? 37.463 61.480 26.248 1.00 52.91 ? 228 PRO A CD 1 ATOM 1855 N N . GLU A 1 229 ? 38.378 62.619 30.711 1.00 72.29 ? 229 GLU A N 1 ATOM 1856 C CA . GLU A 1 229 ? 38.021 62.291 32.082 1.00 71.57 ? 229 GLU A CA 1 ATOM 1857 C C . GLU A 1 229 ? 36.687 62.972 32.392 1.00 79.82 ? 229 GLU A C 1 ATOM 1858 O O . GLU A 1 229 ? 35.800 62.385 33.010 1.00 81.74 ? 229 GLU A O 1 ATOM 1859 C CB . GLU A 1 229 ? 39.101 62.793 33.045 1.00 67.76 ? 229 GLU A CB 1 ATOM 1860 C CG . GLU A 1 229 ? 38.659 62.853 34.499 1.00 74.81 ? 229 GLU A CG 1 ATOM 1861 C CD . GLU A 1 229 ? 39.803 63.158 35.455 1.00 80.59 ? 229 GLU A CD 1 ATOM 1862 O OE1 . GLU A 1 229 ? 40.733 62.327 35.563 1.00 80.63 ? 229 GLU A OE1 1 ATOM 1863 O OE2 . GLU A 1 229 ? 39.770 64.227 36.102 1.00 78.64 ? 229 GLU A OE2 1 ATOM 1864 N N . LEU A 1 230 ? 36.554 64.216 31.948 1.00 79.74 ? 230 LEU A N 1 ATOM 1865 C CA . LEU A 1 230 ? 35.341 64.991 32.162 1.00 78.17 ? 230 LEU A CA 1 ATOM 1866 C C . LEU A 1 230 ? 34.958 65.641 30.840 1.00 83.07 ? 230 LEU A C 1 ATOM 1867 O O . LEU A 1 230 ? 35.716 65.579 29.876 1.00 83.44 ? 230 LEU A O 1 ATOM 1868 C CB . LEU A 1 230 ? 35.584 66.065 33.222 1.00 52.86 ? 230 LEU A CB 1 ATOM 1869 C CG . LEU A 1 230 ? 34.334 66.704 33.829 1.00 61.21 ? 230 LEU A CG 1 ATOM 1870 C CD1 . LEU A 1 230 ? 33.484 65.625 34.481 1.00 67.14 ? 230 LEU A CD1 1 ATOM 1871 C CD2 . LEU A 1 230 ? 34.735 67.758 34.853 1.00 56.65 ? 230 LEU A CD2 1 ATOM 1872 N N . ARG A 1 231 ? 33.791 66.267 30.787 1.00 76.16 ? 231 ARG A N 1 ATOM 1873 C CA . ARG A 1 231 ? 33.352 66.897 29.550 1.00 71.21 ? 231 ARG A CA 1 ATOM 1874 C C . ARG A 1 231 ? 32.032 67.619 29.736 1.00 75.72 ? 231 ARG A C 1 ATOM 1875 O O . ARG A 1 231 ? 31.105 67.085 30.348 1.00 68.83 ? 231 ARG A O 1 ATOM 1876 C CB . ARG A 1 231 ? 33.190 65.848 28.450 1.00 65.09 ? 231 ARG A CB 1 ATOM 1877 C CG . ARG A 1 231 ? 32.522 66.374 27.198 1.00 78.30 ? 231 ARG A CG 1 ATOM 1878 C CD . ARG A 1 231 ? 32.158 65.247 26.255 1.00 85.96 ? 231 ARG A CD 1 ATOM 1879 N NE . ARG A 1 231 ? 33.326 64.468 25.861 1.00 94.13 ? 231 ARG A NE 1 ATOM 1880 C CZ . ARG A 1 231 ? 33.283 63.434 25.028 1.00 96.16 ? 231 ARG A CZ 1 ATOM 1881 N NH1 . ARG A 1 231 ? 32.127 63.054 24.501 1.00 93.34 ? 231 ARG A NH1 1 ATOM 1882 N NH2 . ARG A 1 231 ? 34.396 62.780 24.722 1.00 102.13 ? 231 ARG A NH2 1 ATOM 1883 N N . GLY A 1 232 ? 31.943 68.830 29.199 1.00 49.48 ? 232 GLY A N 1 ATOM 1884 C CA . GLY A 1 232 ? 30.713 69.582 29.325 1.00 49.44 ? 232 GLY A CA 1 ATOM 1885 C C . GLY A 1 232 ? 30.618 70.692 28.308 1.00 57.43 ? 232 GLY A C 1 ATOM 1886 O O . GLY A 1 232 ? 31.591 71.025 27.639 1.00 50.93 ? 232 GLY A O 1 ATOM 1887 N N . ASP A 1 233 ? 29.432 71.261 28.179 1.00 53.20 ? 233 ASP A N 1 ATOM 1888 C CA . ASP A 1 233 ? 29.233 72.353 27.252 1.00 46.75 ? 233 ASP A CA 1 ATOM 1889 C C . ASP A 1 233 ? 28.020 73.162 27.690 1.00 51.47 ? 233 ASP A C 1 ATOM 1890 O O . ASP A 1 233 ? 27.177 72.679 28.442 1.00 47.68 ? 233 ASP A O 1 ATOM 1891 C CB . ASP A 1 233 ? 29.055 71.816 25.829 1.00 44.75 ? 233 ASP A CB 1 ATOM 1892 C CG . ASP A 1 233 ? 27.782 71.023 25.654 1.00 47.40 ? 233 ASP A CG 1 ATOM 1893 O OD1 . ASP A 1 233 ? 26.692 71.601 25.832 1.00 52.82 ? 233 ASP A OD1 1 ATOM 1894 O OD2 . ASP A 1 233 ? 27.866 69.820 25.329 1.00 50.49 ? 233 ASP A OD2 1 ATOM 1895 N N . VAL A 1 234 ? 27.936 74.404 27.237 1.00 35.62 ? 234 VAL A N 1 ATOM 1896 C CA . VAL A 1 234 ? 26.810 75.236 27.613 1.00 35.62 ? 234 VAL A CA 1 ATOM 1897 C C . VAL A 1 234 ? 26.495 76.256 26.540 1.00 35.62 ? 234 VAL A C 1 ATOM 1898 O O . VAL A 1 234 ? 27.347 76.597 25.715 1.00 35.62 ? 234 VAL A O 1 ATOM 1899 C CB . VAL A 1 234 ? 27.073 75.978 28.963 1.00 19.87 ? 234 VAL A CB 1 ATOM 1900 C CG1 . VAL A 1 234 ? 28.331 76.851 28.868 1.00 19.87 ? 234 VAL A CG1 1 ATOM 1901 C CG2 . VAL A 1 234 ? 25.885 76.806 29.328 1.00 19.87 ? 234 VAL A CG2 1 ATOM 1902 N N . LEU A 1 235 ? 25.250 76.724 26.554 1.00 29.42 ? 235 LEU A N 1 ATOM 1903 C CA . LEU A 1 235 ? 24.788 77.722 25.612 1.00 29.42 ? 235 LEU A CA 1 ATOM 1904 C C . LEU A 1 235 ? 24.419 78.942 26.413 1.00 29.42 ? 235 LEU A C 1 ATOM 1905 O O . LEU A 1 235 ? 23.566 78.878 27.282 1.00 29.42 ? 235 LEU A O 1 ATOM 1906 C CB . LEU A 1 235 ? 23.549 77.239 24.848 1.00 31.08 ? 235 LEU A CB 1 ATOM 1907 C CG . LEU A 1 235 ? 22.692 78.400 24.311 1.00 31.08 ? 235 LEU A CG 1 ATOM 1908 C CD1 . LEU A 1 235 ? 23.503 79.159 23.264 1.00 31.08 ? 235 LEU A CD1 1 ATOM 1909 C CD2 . LEU A 1 235 ? 21.381 77.891 23.735 1.00 31.08 ? 235 LEU A CD2 1 ATOM 1910 N N . HIS A 1 236 ? 25.074 80.052 26.125 1.00 37.00 ? 236 HIS A N 1 ATOM 1911 C CA . HIS A 1 236 ? 24.783 81.295 26.812 1.00 37.00 ? 236 HIS A CA 1 ATOM 1912 C C . HIS A 1 236 ? 23.816 82.007 25.890 1.00 37.00 ? 236 HIS A C 1 ATOM 1913 O O . HIS A 1 236 ? 24.209 82.562 24.869 1.00 37.00 ? 236 HIS A O 1 ATOM 1914 C CB . HIS A 1 236 ? 26.070 82.090 27.006 1.00 46.58 ? 236 HIS A CB 1 ATOM 1915 C CG . HIS A 1 236 ? 27.011 81.469 27.991 1.00 47.94 ? 236 HIS A CG 1 ATOM 1916 N ND1 . HIS A 1 236 ? 26.767 81.459 29.349 1.00 46.58 ? 236 HIS A ND1 1 ATOM 1917 C CD2 . HIS A 1 236 ? 28.179 80.808 27.814 1.00 46.58 ? 236 HIS A CD2 1 ATOM 1918 C CE1 . HIS A 1 236 ? 27.744 80.819 29.965 1.00 51.45 ? 236 HIS A CE1 1 ATOM 1919 N NE2 . HIS A 1 236 ? 28.614 80.413 29.057 1.00 51.99 ? 236 HIS A NE2 1 ATOM 1920 N N . ASN A 1 237 ? 22.542 81.967 26.245 1.00 39.89 ? 237 ASN A N 1 ATOM 1921 C CA . ASN A 1 237 ? 21.518 82.569 25.421 1.00 39.89 ? 237 ASN A CA 1 ATOM 1922 C C . ASN A 1 237 ? 21.632 84.076 25.284 1.00 39.89 ? 237 ASN A C 1 ATOM 1923 O O . ASN A 1 237 ? 21.393 84.610 24.199 1.00 39.89 ? 237 ASN A O 1 ATOM 1924 C CB . ASN A 1 237 ? 20.132 82.220 25.957 1.00 34.68 ? 237 ASN A CB 1 ATOM 1925 C CG . ASN A 1 237 ? 19.028 82.675 25.032 1.00 34.68 ? 237 ASN A CG 1 ATOM 1926 O OD1 . ASN A 1 237 ? 18.729 82.014 24.035 1.00 34.68 ? 237 ASN A OD1 1 ATOM 1927 N ND2 . ASN A 1 237 ? 18.428 83.826 25.345 1.00 34.68 ? 237 ASN A ND2 1 ATOM 1928 N N . GLY A 1 238 ? 21.982 84.761 26.373 1.00 34.58 ? 238 GLY A N 1 ATOM 1929 C CA . GLY A 1 238 ? 22.095 86.215 26.332 1.00 34.58 ? 238 GLY A CA 1 ATOM 1930 C C . GLY A 1 238 ? 23.071 86.671 25.268 1.00 34.58 ? 238 GLY A C 1 ATOM 1931 O O . GLY A 1 238 ? 22.940 87.745 24.689 1.00 34.58 ? 238 GLY A O 1 ATOM 1932 N N . ASN A 1 239 ? 24.041 85.806 25.006 1.00 50.05 ? 239 ASN A N 1 ATOM 1933 C CA . ASN A 1 239 ? 25.105 86.034 24.041 1.00 54.21 ? 239 ASN A CA 1 ATOM 1934 C C . ASN A 1 239 ? 24.802 85.393 22.689 1.00 50.05 ? 239 ASN A C 1 ATOM 1935 O O . ASN A 1 239 ? 25.045 85.979 21.635 1.00 50.05 ? 239 ASN A O 1 ATOM 1936 C CB . ASN A 1 239 ? 26.385 85.406 24.585 1.00 52.03 ? 239 ASN A CB 1 ATOM 1937 C CG . ASN A 1 239 ? 27.552 86.316 24.482 1.00 63.45 ? 239 ASN A CG 1 ATOM 1938 O OD1 . ASN A 1 239 ? 27.918 86.740 23.391 1.00 87.60 ? 239 ASN A OD1 1 ATOM 1939 N ND2 . ASN A 1 239 ? 28.142 86.634 25.626 1.00 49.67 ? 239 ASN A ND2 1 ATOM 1940 N N . GLY A 1 240 ? 24.299 84.162 22.744 1.00 34.36 ? 240 GLY A N 1 ATOM 1941 C CA . GLY A 1 240 ? 24.002 83.412 21.546 1.00 34.36 ? 240 GLY A CA 1 ATOM 1942 C C . GLY A 1 240 ? 25.208 82.556 21.234 1.00 34.36 ? 240 GLY A C 1 ATOM 1943 O O . GLY A 1 240 ? 25.378 82.103 20.101 1.00 34.36 ? 240 GLY A O 1 ATOM 1944 N N . THR A 1 241 ? 26.042 82.318 22.248 1.00 36.16 ? 241 THR A N 1 ATOM 1945 C CA . THR A 1 241 ? 27.267 81.526 22.079 1.00 36.16 ? 241 THR A CA 1 ATOM 1946 C C . THR A 1 241 ? 27.402 80.302 22.979 1.00 36.16 ? 241 THR A C 1 ATOM 1947 O O . THR A 1 241 ? 26.880 80.265 24.088 1.00 36.16 ? 241 THR A O 1 ATOM 1948 C CB . THR A 1 241 ? 28.521 82.397 22.286 1.00 57.48 ? 241 THR A CB 1 ATOM 1949 O OG1 . THR A 1 241 ? 28.421 83.092 23.536 1.00 56.42 ? 241 THR A OG1 1 ATOM 1950 C CG2 . THR A 1 241 ? 28.655 83.400 21.158 1.00 57.36 ? 241 THR A CG2 1 ATOM 1951 N N . TYR A 1 242 ? 28.121 79.306 22.472 1.00 35.49 ? 242 TYR A N 1 ATOM 1952 C CA . TYR A 1 242 ? 28.364 78.058 23.178 1.00 35.49 ? 242 TYR A CA 1 ATOM 1953 C C . TYR A 1 242 ? 29.766 78.017 23.741 1.00 36.00 ? 242 TYR A C 1 ATOM 1954 O O . TYR A 1 242 ? 30.604 78.850 23.424 1.00 35.49 ? 242 TYR A O 1 ATOM 1955 C CB . TYR A 1 242 ? 28.240 76.856 22.238 1.00 38.61 ? 242 TYR A CB 1 ATOM 1956 C CG . TYR A 1 242 ? 26.847 76.532 21.792 1.00 40.31 ? 242 TYR A CG 1 ATOM 1957 C CD1 . TYR A 1 242 ? 26.244 77.240 20.751 1.00 38.94 ? 242 TYR A CD1 1 ATOM 1958 C CD2 . TYR A 1 242 ? 26.109 75.541 22.437 1.00 38.61 ? 242 TYR A CD2 1 ATOM 1959 C CE1 . TYR A 1 242 ? 24.935 76.970 20.368 1.00 38.61 ? 242 TYR A CE1 1 ATOM 1960 C CE2 . TYR A 1 242 ? 24.801 75.269 22.063 1.00 38.61 ? 242 TYR A CE2 1 ATOM 1961 C CZ . TYR A 1 242 ? 24.220 75.988 21.033 1.00 38.61 ? 242 TYR A CZ 1 ATOM 1962 O OH . TYR A 1 242 ? 22.916 75.760 20.700 1.00 38.61 ? 242 TYR A OH 1 ATOM 1963 N N . GLN A 1 243 ? 30.005 77.004 24.561 1.00 46.93 ? 243 GLN A N 1 ATOM 1964 C CA . GLN A 1 243 ? 31.295 76.752 25.172 1.00 46.93 ? 243 GLN A CA 1 ATOM 1965 C C . GLN A 1 243 ? 31.302 75.255 25.371 1.00 48.50 ? 243 GLN A C 1 ATOM 1966 O O . GLN A 1 243 ? 30.320 74.691 25.838 1.00 46.93 ? 243 GLN A O 1 ATOM 1967 C CB . GLN A 1 243 ? 31.420 77.448 26.518 1.00 35.69 ? 243 GLN A CB 1 ATOM 1968 C CG . GLN A 1 243 ? 31.559 78.943 26.421 1.00 35.69 ? 243 GLN A CG 1 ATOM 1969 C CD . GLN A 1 243 ? 31.921 79.549 27.750 1.00 35.69 ? 243 GLN A CD 1 ATOM 1970 O OE1 . GLN A 1 243 ? 32.476 78.872 28.605 1.00 40.69 ? 243 GLN A OE1 1 ATOM 1971 N NE2 . GLN A 1 243 ? 31.628 80.835 27.930 1.00 37.44 ? 243 GLN A NE2 1 ATOM 1972 N N . SER A 1 244 ? 32.394 74.609 24.992 1.00 38.73 ? 244 SER A N 1 ATOM 1973 C CA . SER A 1 244 ? 32.502 73.171 25.126 1.00 38.73 ? 244 SER A CA 1 ATOM 1974 C C . SER A 1 244 ? 33.896 72.873 25.638 1.00 47.93 ? 244 SER A C 1 ATOM 1975 O O . SER A 1 244 ? 34.877 73.408 25.131 1.00 44.07 ? 244 SER A O 1 ATOM 1976 C CB . SER A 1 244 ? 32.283 72.507 23.770 1.00 24.79 ? 244 SER A CB 1 ATOM 1977 O OG . SER A 1 244 ? 32.194 71.098 23.894 1.00 28.68 ? 244 SER A OG 1 ATOM 1978 N N . TRP A 1 245 ? 33.986 72.022 26.646 1.00 43.88 ? 245 TRP A N 1 ATOM 1979 C CA . TRP A 1 245 ? 35.278 71.700 27.213 1.00 42.72 ? 245 TRP A CA 1 ATOM 1980 C C . TRP A 1 245 ? 35.486 70.203 27.419 1.00 52.58 ? 245 TRP A C 1 ATOM 1981 O O . TRP A 1 245 ? 34.543 69.407 27.371 1.00 45.49 ? 245 TRP A O 1 ATOM 1982 C CB . TRP A 1 245 ? 35.461 72.461 28.529 1.00 43.42 ? 245 TRP A CB 1 ATOM 1983 C CG . TRP A 1 245 ? 34.417 72.157 29.545 1.00 53.07 ? 245 TRP A CG 1 ATOM 1984 C CD1 . TRP A 1 245 ? 34.453 71.170 30.490 1.00 55.28 ? 245 TRP A CD1 1 ATOM 1985 C CD2 . TRP A 1 245 ? 33.152 72.810 29.694 1.00 59.86 ? 245 TRP A CD2 1 ATOM 1986 N NE1 . TRP A 1 245 ? 33.290 71.167 31.217 1.00 56.06 ? 245 TRP A NE1 1 ATOM 1987 C CE2 . TRP A 1 245 ? 32.471 72.163 30.750 1.00 60.16 ? 245 TRP A CE2 1 ATOM 1988 C CE3 . TRP A 1 245 ? 32.524 73.877 29.037 1.00 61.72 ? 245 TRP A CE3 1 ATOM 1989 C CZ2 . TRP A 1 245 ? 31.183 72.549 31.166 1.00 65.84 ? 245 TRP A CZ2 1 ATOM 1990 C CZ3 . TRP A 1 245 ? 31.241 74.261 29.452 1.00 69.29 ? 245 TRP A CZ3 1 ATOM 1991 C CH2 . TRP A 1 245 ? 30.588 73.595 30.507 1.00 67.21 ? 245 TRP A CH2 1 ATOM 1992 N N . VAL A 1 246 ? 36.749 69.841 27.619 1.00 52.35 ? 246 VAL A N 1 ATOM 1993 C CA . VAL A 1 246 ? 37.166 68.467 27.838 1.00 59.24 ? 246 VAL A CA 1 ATOM 1994 C C . VAL A 1 246 ? 38.307 68.509 28.842 1.00 62.88 ? 246 VAL A C 1 ATOM 1995 O O . VAL A 1 246 ? 39.116 69.434 28.830 1.00 58.17 ? 246 VAL A O 1 ATOM 1996 C CB . VAL A 1 246 ? 37.686 67.829 26.548 1.00 45.00 ? 246 VAL A CB 1 ATOM 1997 C CG1 . VAL A 1 246 ? 37.961 66.363 26.787 1.00 53.81 ? 246 VAL A CG1 1 ATOM 1998 C CG2 . VAL A 1 246 ? 36.678 68.019 25.417 1.00 47.36 ? 246 VAL A CG2 1 ATOM 1999 N N . VAL A 1 247 ? 38.372 67.516 29.716 1.00 59.17 ? 247 VAL A N 1 ATOM 2000 C CA . VAL A 1 247 ? 39.426 67.483 30.715 1.00 63.62 ? 247 VAL A CA 1 ATOM 2001 C C . VAL A 1 247 ? 40.041 66.108 30.861 1.00 65.24 ? 247 VAL A C 1 ATOM 2002 O O . VAL A 1 247 ? 39.341 65.123 31.083 1.00 64.57 ? 247 VAL A O 1 ATOM 2003 C CB . VAL A 1 247 ? 38.904 67.921 32.091 1.00 49.02 ? 247 VAL A CB 1 ATOM 2004 C CG1 . VAL A 1 247 ? 40.001 67.776 33.133 1.00 50.76 ? 247 VAL A CG1 1 ATOM 2005 C CG2 . VAL A 1 247 ? 38.430 69.363 32.028 1.00 47.10 ? 247 VAL A CG2 1 ATOM 2006 N N . VAL A 1 248 ? 41.360 66.048 30.734 1.00 69.64 ? 248 VAL A N 1 ATOM 2007 C CA . VAL A 1 248 ? 42.081 64.793 30.878 1.00 68.33 ? 248 VAL A CA 1 ATOM 2008 C C . VAL A 1 248 ? 43.020 64.860 32.082 1.00 70.34 ? 248 VAL A C 1 ATOM 2009 O O . VAL A 1 248 ? 43.518 65.931 32.443 1.00 65.28 ? 248 VAL A O 1 ATOM 2010 C CB . VAL A 1 248 ? 42.912 64.472 29.622 1.00 74.49 ? 248 VAL A CB 1 ATOM 2011 C CG1 . VAL A 1 248 ? 41.991 64.169 28.451 1.00 68.28 ? 248 VAL A CG1 1 ATOM 2012 C CG2 . VAL A 1 248 ? 43.823 65.644 29.297 1.00 70.50 ? 248 VAL A CG2 1 ATOM 2013 N N . ALA A 1 249 ? 43.230 63.714 32.721 1.00 74.10 ? 249 ALA A N 1 ATOM 2014 C CA . ALA A 1 249 ? 44.132 63.634 33.859 1.00 76.23 ? 249 ALA A CA 1 ATOM 2015 C C . ALA A 1 249 ? 45.421 63.072 33.278 1.00 73.85 ? 249 ALA A C 1 ATOM 2016 O O . ALA A 1 249 ? 45.384 62.156 32.452 1.00 64.90 ? 249 ALA A O 1 ATOM 2017 C CB . ALA A 1 249 ? 43.572 62.700 34.920 1.00 76.72 ? 249 ALA A CB 1 ATOM 2018 N N . VAL A 1 250 ? 46.555 63.625 33.693 1.00 72.54 ? 250 VAL A N 1 ATOM 2019 C CA . VAL A 1 250 ? 47.839 63.170 33.178 1.00 81.93 ? 250 VAL A CA 1 ATOM 2020 C C . VAL A 1 250 ? 48.705 62.471 34.226 1.00 80.56 ? 250 VAL A C 1 ATOM 2021 O O . VAL A 1 250 ? 48.865 62.962 35.347 1.00 78.10 ? 250 VAL A O 1 ATOM 2022 C CB . VAL A 1 250 ? 48.635 64.354 32.564 1.00 93.39 ? 250 VAL A CB 1 ATOM 2023 C CG1 . VAL A 1 250 ? 48.834 65.447 33.596 1.00 89.40 ? 250 VAL A CG1 1 ATOM 2024 C CG2 . VAL A 1 250 ? 49.976 63.869 32.047 1.00 93.27 ? 250 VAL A CG2 1 ATOM 2025 N N . PRO A 1 251 ? 49.266 61.301 33.873 1.00 85.68 ? 251 PRO A N 1 ATOM 2026 C CA . PRO A 1 251 ? 50.120 60.547 34.796 1.00 91.39 ? 251 PRO A CA 1 ATOM 2027 C C . PRO A 1 251 ? 51.194 61.468 35.378 1.00 96.32 ? 251 PRO A C 1 ATOM 2028 O O . PRO A 1 251 ? 51.818 62.243 34.652 1.00 95.53 ? 251 PRO A O 1 ATOM 2029 C CB . PRO A 1 251 ? 50.705 59.455 33.906 1.00 77.11 ? 251 PRO A CB 1 ATOM 2030 C CG . PRO A 1 251 ? 49.578 59.183 32.937 1.00 75.68 ? 251 PRO A CG 1 ATOM 2031 C CD . PRO A 1 251 ? 49.108 60.585 32.592 1.00 73.76 ? 251 PRO A CD 1 ATOM 2032 N N . PRO A 1 252 ? 51.426 61.388 36.698 1.00 118.09 ? 252 PRO A N 1 ATOM 2033 C CA . PRO A 1 252 ? 52.424 62.219 37.385 1.00 119.22 ? 252 PRO A CA 1 ATOM 2034 C C . PRO A 1 252 ? 53.853 62.136 36.843 1.00 120.16 ? 252 PRO A C 1 ATOM 2035 O O . PRO A 1 252 ? 54.727 62.893 37.268 1.00 120.49 ? 252 PRO A O 1 ATOM 2036 C CB . PRO A 1 252 ? 52.320 61.746 38.835 1.00 99.75 ? 252 PRO A CB 1 ATOM 2037 C CG . PRO A 1 252 ? 51.927 60.306 38.686 1.00 100.63 ? 252 PRO A CG 1 ATOM 2038 C CD . PRO A 1 252 ? 50.870 60.377 37.615 1.00 99.10 ? 252 PRO A CD 1 ATOM 2039 N N . GLN A 1 253 ? 54.086 61.229 35.901 1.00 127.70 ? 253 GLN A N 1 ATOM 2040 C CA . GLN A 1 253 ? 55.417 61.063 35.332 1.00 130.64 ? 253 GLN A CA 1 ATOM 2041 C C . GLN A 1 253 ? 55.396 61.107 33.807 1.00 130.40 ? 253 GLN A C 1 ATOM 2042 O O . GLN A 1 253 ? 56.437 60.999 33.161 1.00 128.95 ? 253 GLN A O 1 ATOM 2043 C CB . GLN A 1 253 ? 56.018 59.733 35.802 1.00 168.88 ? 253 GLN A CB 1 ATOM 2044 C CG . GLN A 1 253 ? 57.474 59.516 35.412 1.00 171.64 ? 253 GLN A CG 1 ATOM 2045 C CD . GLN A 1 253 ? 58.006 58.163 35.859 1.00 177.32 ? 253 GLN A CD 1 ATOM 2046 O OE1 . GLN A 1 253 ? 57.982 57.836 37.046 1.00 178.93 ? 253 GLN A OE1 1 ATOM 2047 N NE2 . GLN A 1 253 ? 58.490 57.372 34.908 1.00 175.35 ? 253 GLN A NE2 1 ATOM 2048 N N . ASP A 1 254 ? 54.211 61.272 33.232 1.00 114.38 ? 254 ASP A N 1 ATOM 2049 C CA . ASP A 1 254 ? 54.084 61.317 31.780 1.00 113.05 ? 254 ASP A CA 1 ATOM 2050 C C . ASP A 1 254 ? 54.786 62.546 31.211 1.00 109.02 ? 254 ASP A C 1 ATOM 2051 O O . ASP A 1 254 ? 54.646 63.652 31.736 1.00 104.68 ? 254 ASP A O 1 ATOM 2052 C CB . ASP A 1 254 ? 52.608 61.334 31.377 1.00 101.51 ? 254 ASP A CB 1 ATOM 2053 C CG . ASP A 1 254 ? 52.386 60.849 29.957 1.00 103.16 ? 254 ASP A CG 1 ATOM 2054 O OD1 . ASP A 1 254 ? 53.039 61.379 29.036 1.00 105.80 ? 254 ASP A OD1 1 ATOM 2055 O OD2 . ASP A 1 254 ? 51.556 59.936 29.764 1.00 107.20 ? 254 ASP A OD2 1 ATOM 2056 N N . THR A 1 255 ? 55.538 62.342 30.132 1.00 124.25 ? 255 THR A N 1 ATOM 2057 C CA . THR A 1 255 ? 56.273 63.424 29.485 1.00 125.23 ? 255 THR A CA 1 ATOM 2058 C C . THR A 1 255 ? 55.756 63.671 28.072 1.00 121.15 ? 255 THR A C 1 ATOM 2059 O O . THR A 1 255 ? 56.065 64.691 27.454 1.00 121.09 ? 255 THR A O 1 ATOM 2060 C CB . THR A 1 255 ? 57.774 63.093 29.394 1.00 113.68 ? 255 THR A CB 1 ATOM 2061 O OG1 . THR A 1 255 ? 58.252 62.688 30.681 1.00 111.50 ? 255 THR A OG1 1 ATOM 2062 C CG2 . THR A 1 255 ? 58.563 64.311 28.935 1.00 114.23 ? 255 THR A CG2 1 ATOM 2063 N N . ALA A 1 256 ? 54.966 62.727 27.570 1.00 103.84 ? 256 ALA A N 1 ATOM 2064 C CA . ALA A 1 256 ? 54.398 62.807 26.226 1.00 102.22 ? 256 ALA A CA 1 ATOM 2065 C C . ALA A 1 256 ? 53.867 64.193 25.859 1.00 100.35 ? 256 ALA A C 1 ATOM 2066 O O . ALA A 1 256 ? 53.667 65.052 26.723 1.00 88.99 ? 256 ALA A O 1 ATOM 2067 C CB . ALA A 1 256 ? 53.287 61.767 26.070 1.00 77.10 ? 256 ALA A CB 1 ATOM 2068 N N . PRO A 1 257 ? 53.643 64.426 24.556 1.00 108.57 ? 257 PRO A N 1 ATOM 2069 C CA . PRO A 1 257 ? 53.132 65.706 24.058 1.00 107.28 ? 257 PRO A CA 1 ATOM 2070 C C . PRO A 1 257 ? 51.601 65.778 24.082 1.00 105.33 ? 257 PRO A C 1 ATOM 2071 O O . PRO A 1 257 ? 50.922 64.948 23.469 1.00 102.59 ? 257 PRO A O 1 ATOM 2072 C CB . PRO A 1 257 ? 53.698 65.765 22.642 1.00 86.98 ? 257 PRO A CB 1 ATOM 2073 C CG . PRO A 1 257 ? 53.619 64.327 22.212 1.00 89.63 ? 257 PRO A CG 1 ATOM 2074 C CD . PRO A 1 257 ? 54.115 63.578 23.442 1.00 89.42 ? 257 PRO A CD 1 ATOM 2075 N N . TYR A 1 258 ? 51.065 66.765 24.796 1.00 76.37 ? 258 TYR A N 1 ATOM 2076 C CA . TYR A 1 258 ? 49.618 66.947 24.889 1.00 76.49 ? 258 TYR A CA 1 ATOM 2077 C C . TYR A 1 258 ? 49.150 68.165 24.108 1.00 72.75 ? 258 TYR A C 1 ATOM 2078 O O . TYR A 1 258 ? 49.593 69.288 24.356 1.00 72.06 ? 258 TYR A O 1 ATOM 2079 C CB . TYR A 1 258 ? 49.173 67.089 26.346 1.00 90.84 ? 258 TYR A CB 1 ATOM 2080 C CG . TYR A 1 258 ? 49.055 65.779 27.089 1.00 98.26 ? 258 TYR A CG 1 ATOM 2081 C CD1 . TYR A 1 258 ? 50.004 65.404 28.038 1.00 94.87 ? 258 TYR A CD1 1 ATOM 2082 C CD2 . TYR A 1 258 ? 47.993 64.910 26.842 1.00 97.08 ? 258 TYR A CD2 1 ATOM 2083 C CE1 . TYR A 1 258 ? 49.899 64.198 28.725 1.00 99.28 ? 258 TYR A CE1 1 ATOM 2084 C CE2 . TYR A 1 258 ? 47.879 63.700 27.522 1.00 100.50 ? 258 TYR A CE2 1 ATOM 2085 C CZ . TYR A 1 258 ? 48.836 63.351 28.462 1.00 100.43 ? 258 TYR A CZ 1 ATOM 2086 O OH . TYR A 1 258 ? 48.731 62.158 29.139 1.00 99.13 ? 258 TYR A OH 1 ATOM 2087 N N . SER A 1 259 ? 48.239 67.933 23.169 1.00 82.93 ? 259 SER A N 1 ATOM 2088 C CA . SER A 1 259 ? 47.702 69.003 22.342 1.00 85.08 ? 259 SER A CA 1 ATOM 2089 C C . SER A 1 259 ? 46.184 68.897 22.219 1.00 82.77 ? 259 SER A C 1 ATOM 2090 O O . SER A 1 259 ? 45.636 67.796 22.143 1.00 73.24 ? 259 SER A O 1 ATOM 2091 C CB . SER A 1 259 ? 48.336 68.945 20.950 1.00 79.90 ? 259 SER A CB 1 ATOM 2092 O OG . SER A 1 259 ? 49.746 69.069 21.026 1.00 96.94 ? 259 SER A OG 1 ATOM 2093 N N . CYS A 1 260 ? 45.503 70.041 22.207 1.00 68.41 ? 260 CYS A N 1 ATOM 2094 C CA . CYS A 1 260 ? 44.053 70.037 22.069 1.00 64.89 ? 260 CYS A CA 1 ATOM 2095 C C . CYS A 1 260 ? 43.622 70.260 20.636 1.00 62.06 ? 260 CYS A C 1 ATOM 2096 O O . CYS A 1 260 ? 44.254 71.012 19.896 1.00 62.41 ? 260 CYS A O 1 ATOM 2097 C CB . CYS A 1 260 ? 43.392 71.114 22.916 1.00 87.12 ? 260 CYS A CB 1 ATOM 2098 S SG . CYS A 1 260 ? 41.585 70.980 22.742 1.00 91.13 ? 260 CYS A SG 1 ATOM 2099 N N . HIS A 1 261 ? 42.529 69.614 20.251 1.00 63.76 ? 261 HIS A N 1 ATOM 2100 C CA . HIS A 1 261 ? 42.018 69.756 18.899 1.00 60.75 ? 261 HIS A CA 1 ATOM 2101 C C . HIS A 1 261 ? 40.572 70.247 18.876 1.00 69.69 ? 261 HIS A C 1 ATOM 2102 O O . HIS A 1 261 ? 39.744 69.834 19.694 1.00 61.11 ? 261 HIS A O 1 ATOM 2103 C CB . HIS A 1 261 ? 42.133 68.428 18.146 1.00 64.06 ? 261 HIS A CB 1 ATOM 2104 C CG . HIS A 1 261 ? 43.541 67.938 18.000 1.00 76.76 ? 261 HIS A CG 1 ATOM 2105 N ND1 . HIS A 1 261 ? 43.891 66.926 17.132 1.00 78.32 ? 261 HIS A ND1 1 ATOM 2106 C CD2 . HIS A 1 261 ? 44.686 68.312 18.620 1.00 80.93 ? 261 HIS A CD2 1 ATOM 2107 C CE1 . HIS A 1 261 ? 45.189 66.699 17.224 1.00 83.27 ? 261 HIS A CE1 1 ATOM 2108 N NE2 . HIS A 1 261 ? 45.694 67.526 18.121 1.00 83.68 ? 261 HIS A NE2 1 ATOM 2109 N N . VAL A 1 262 ? 40.280 71.139 17.935 1.00 55.29 ? 262 VAL A N 1 ATOM 2110 C CA . VAL A 1 262 ? 38.940 71.683 17.802 1.00 49.07 ? 262 VAL A CA 1 ATOM 2111 C C . VAL A 1 262 ? 38.493 71.701 16.346 1.00 53.75 ? 262 VAL A C 1 ATOM 2112 O O . VAL A 1 262 ? 39.176 72.242 15.481 1.00 54.88 ? 262 VAL A O 1 ATOM 2113 C CB . VAL A 1 262 ? 38.860 73.130 18.360 1.00 41.02 ? 262 VAL A CB 1 ATOM 2114 C CG1 . VAL A 1 262 ? 37.450 73.685 18.178 1.00 42.11 ? 262 VAL A CG1 1 ATOM 2115 C CG2 . VAL A 1 262 ? 39.246 73.147 19.825 1.00 40.18 ? 262 VAL A CG2 1 ATOM 2116 N N . GLN A 1 263 ? 37.348 71.091 16.078 1.00 55.14 ? 263 GLN A N 1 ATOM 2117 C CA . GLN A 1 263 ? 36.799 71.082 14.732 1.00 53.82 ? 263 GLN A CA 1 ATOM 2118 C C . GLN A 1 263 ? 35.430 71.733 14.811 1.00 60.01 ? 263 GLN A C 1 ATOM 2119 O O . GLN A 1 263 ? 34.621 71.388 15.666 1.00 58.80 ? 263 GLN A O 1 ATOM 2120 C CB . GLN A 1 263 ? 36.663 69.658 14.184 1.00 71.79 ? 263 GLN A CB 1 ATOM 2121 C CG . GLN A 1 263 ? 35.917 69.581 12.849 1.00 81.93 ? 263 GLN A CG 1 ATOM 2122 C CD . GLN A 1 263 ? 36.594 70.371 11.734 1.00 99.61 ? 263 GLN A CD 1 ATOM 2123 O OE1 . GLN A 1 263 ? 36.858 71.567 11.871 1.00 100.66 ? 263 GLN A OE1 1 ATOM 2124 N NE2 . GLN A 1 263 ? 36.869 69.702 10.619 1.00 105.69 ? 263 GLN A NE2 1 ATOM 2125 N N . HIS A 1 264 ? 35.179 72.683 13.923 1.00 49.58 ? 264 HIS A N 1 ATOM 2126 C CA . HIS A 1 264 ? 33.912 73.383 13.907 1.00 50.22 ? 264 HIS A CA 1 ATOM 2127 C C . HIS A 1 264 ? 33.569 73.733 12.471 1.00 54.36 ? 264 HIS A C 1 ATOM 2128 O O . HIS A 1 264 ? 34.447 73.806 11.620 1.00 55.53 ? 264 HIS A O 1 ATOM 2129 C CB . HIS A 1 264 ? 34.010 74.645 14.767 1.00 48.39 ? 264 HIS A CB 1 ATOM 2130 C CG . HIS A 1 264 ? 32.718 75.384 14.907 1.00 53.45 ? 264 HIS A CG 1 ATOM 2131 N ND1 . HIS A 1 264 ? 32.457 76.557 14.236 1.00 48.39 ? 264 HIS A ND1 1 ATOM 2132 C CD2 . HIS A 1 264 ? 31.611 75.112 15.637 1.00 48.39 ? 264 HIS A CD2 1 ATOM 2133 C CE1 . HIS A 1 264 ? 31.245 76.980 14.549 1.00 54.49 ? 264 HIS A CE1 1 ATOM 2134 N NE2 . HIS A 1 264 ? 30.710 76.121 15.397 1.00 48.39 ? 264 HIS A NE2 1 ATOM 2135 N N . SER A 1 265 ? 32.287 73.940 12.204 1.00 43.51 ? 265 SER A N 1 ATOM 2136 C CA . SER A 1 265 ? 31.829 74.262 10.859 1.00 45.41 ? 265 SER A CA 1 ATOM 2137 C C . SER A 1 265 ? 32.376 75.586 10.328 1.00 45.50 ? 265 SER A C 1 ATOM 2138 O O . SER A 1 265 ? 32.540 75.749 9.122 1.00 50.33 ? 265 SER A O 1 ATOM 2139 C CB . SER A 1 265 ? 30.306 74.297 10.842 1.00 31.38 ? 265 SER A CB 1 ATOM 2140 O OG . SER A 1 265 ? 29.836 75.226 11.801 1.00 31.82 ? 265 SER A OG 1 ATOM 2141 N N . SER A 1 266 ? 32.662 76.524 11.227 1.00 54.53 ? 266 SER A N 1 ATOM 2142 C CA . SER A 1 266 ? 33.169 77.839 10.834 1.00 52.78 ? 266 SER A CA 1 ATOM 2143 C C . SER A 1 266 ? 34.666 77.850 10.530 1.00 58.36 ? 266 SER A C 1 ATOM 2144 O O . SER A 1 266 ? 35.224 78.892 10.186 1.00 58.39 ? 266 SER A O 1 ATOM 2145 C CB . SER A 1 266 ? 32.894 78.861 11.936 1.00 49.49 ? 266 SER A CB 1 ATOM 2146 O OG . SER A 1 266 ? 33.759 78.654 13.043 1.00 49.49 ? 266 SER A OG 1 ATOM 2147 N N . LEU A 1 267 ? 35.316 76.699 10.660 1.00 50.47 ? 267 LEU A N 1 ATOM 2148 C CA . LEU A 1 267 ? 36.744 76.620 10.407 1.00 51.67 ? 267 LEU A CA 1 ATOM 2149 C C . LEU A 1 267 ? 37.060 75.949 9.083 1.00 60.83 ? 267 LEU A C 1 ATOM 2150 O O . LEU A 1 267 ? 36.491 74.907 8.751 1.00 60.03 ? 267 LEU A O 1 ATOM 2151 C CB . LEU A 1 267 ? 37.444 75.863 11.535 1.00 42.96 ? 267 LEU A CB 1 ATOM 2152 C CG . LEU A 1 267 ? 37.203 76.435 12.928 1.00 46.54 ? 267 LEU A CG 1 ATOM 2153 C CD1 . LEU A 1 267 ? 37.916 75.580 13.970 1.00 44.24 ? 267 LEU A CD1 1 ATOM 2154 C CD2 . LEU A 1 267 ? 37.676 77.876 12.969 1.00 41.23 ? 267 LEU A CD2 1 ATOM 2155 N N . ALA A 1 268 ? 37.982 76.558 8.339 1.00 61.72 ? 268 ALA A N 1 ATOM 2156 C CA . ALA A 1 268 ? 38.412 76.041 7.048 1.00 66.27 ? 268 ALA A CA 1 ATOM 2157 C C . ALA A 1 268 ? 39.146 74.731 7.264 1.00 65.27 ? 268 ALA A C 1 ATOM 2158 O O . ALA A 1 268 ? 39.201 73.890 6.371 1.00 62.64 ? 268 ALA A O 1 ATOM 2159 C CB . ALA A 1 268 ? 39.323 77.044 6.363 1.00 90.41 ? 268 ALA A CB 1 ATOM 2160 N N . GLN A 1 269 ? 39.722 74.575 8.453 1.00 62.36 ? 269 GLN A N 1 ATOM 2161 C CA . GLN A 1 269 ? 40.450 73.363 8.827 1.00 60.27 ? 269 GLN A CA 1 ATOM 2162 C C . GLN A 1 269 ? 40.523 73.311 10.343 1.00 57.20 ? 269 GLN A C 1 ATOM 2163 O O . GLN A 1 269 ? 40.457 74.345 11.011 1.00 54.21 ? 269 GLN A O 1 ATOM 2164 C CB . GLN A 1 269 ? 41.877 73.354 8.254 1.00 69.94 ? 269 GLN A CB 1 ATOM 2165 C CG . GLN A 1 269 ? 42.248 74.553 7.386 1.00 87.57 ? 269 GLN A CG 1 ATOM 2166 C CD . GLN A 1 269 ? 42.667 75.765 8.195 1.00 82.12 ? 269 GLN A CD 1 ATOM 2167 O OE1 . GLN A 1 269 ? 41.919 76.260 9.040 1.00 79.52 ? 269 GLN A OE1 1 ATOM 2168 N NE2 . GLN A 1 269 ? 43.872 76.253 7.933 1.00 91.42 ? 269 GLN A NE2 1 ATOM 2169 N N . PRO A 1 270 ? 40.657 72.105 10.909 1.00 48.22 ? 270 PRO A N 1 ATOM 2170 C CA . PRO A 1 270 ? 40.734 71.968 12.365 1.00 51.34 ? 270 PRO A CA 1 ATOM 2171 C C . PRO A 1 270 ? 41.801 72.843 13.008 1.00 52.99 ? 270 PRO A C 1 ATOM 2172 O O . PRO A 1 270 ? 42.679 73.385 12.332 1.00 54.54 ? 270 PRO A O 1 ATOM 2173 C CB . PRO A 1 270 ? 40.991 70.472 12.564 1.00 69.82 ? 270 PRO A CB 1 ATOM 2174 C CG . PRO A 1 270 ? 41.602 70.041 11.270 1.00 69.61 ? 270 PRO A CG 1 ATOM 2175 C CD . PRO A 1 270 ? 40.793 70.796 10.255 1.00 72.35 ? 270 PRO A CD 1 ATOM 2176 N N . LEU A 1 271 ? 41.698 72.995 14.322 1.00 74.88 ? 271 LEU A N 1 ATOM 2177 C CA . LEU A 1 271 ? 42.643 73.801 15.075 1.00 71.96 ? 271 LEU A CA 1 ATOM 2178 C C . LEU A 1 271 ? 43.375 72.933 16.076 1.00 75.84 ? 271 LEU A C 1 ATOM 2179 O O . LEU A 1 271 ? 42.832 71.948 16.573 1.00 78.11 ? 271 LEU A O 1 ATOM 2180 C CB . LEU A 1 271 ? 41.917 74.928 15.810 1.00 60.34 ? 271 LEU A CB 1 ATOM 2181 C CG . LEU A 1 271 ? 42.079 76.324 15.207 1.00 74.71 ? 271 LEU A CG 1 ATOM 2182 C CD1 . LEU A 1 271 ? 41.632 76.315 13.751 1.00 87.03 ? 271 LEU A CD1 1 ATOM 2183 C CD2 . LEU A 1 271 ? 41.274 77.321 16.022 1.00 71.57 ? 271 LEU A CD2 1 ATOM 2184 N N . VAL A 1 272 ? 44.613 73.303 16.369 1.00 58.48 ? 272 VAL A N 1 ATOM 2185 C CA . VAL A 1 272 ? 45.416 72.553 17.316 1.00 57.32 ? 272 VAL A CA 1 ATOM 2186 C C . VAL A 1 272 ? 46.030 73.499 18.337 1.00 59.12 ? 272 VAL A C 1 ATOM 2187 O O . VAL A 1 272 ? 46.488 74.592 17.999 1.00 62.41 ? 272 VAL A O 1 ATOM 2188 C CB . VAL A 1 272 ? 46.541 71.780 16.603 1.00 40.10 ? 272 VAL A CB 1 ATOM 2189 C CG1 . VAL A 1 272 ? 47.337 70.977 17.629 1.00 39.90 ? 272 VAL A CG1 1 ATOM 2190 C CG2 . VAL A 1 272 ? 45.949 70.867 15.518 1.00 34.47 ? 272 VAL A CG2 1 ATOM 2191 N N . VAL A 1 273 ? 46.027 73.081 19.593 1.00 52.35 ? 273 VAL A N 1 ATOM 2192 C CA . VAL A 1 273 ? 46.588 73.907 20.645 1.00 59.00 ? 273 VAL A CA 1 ATOM 2193 C C . VAL A 1 273 ? 47.325 73.041 21.645 1.00 68.48 ? 273 VAL A C 1 ATOM 2194 O O . VAL A 1 273 ? 46.724 72.496 22.571 1.00 72.34 ? 273 VAL A O 1 ATOM 2195 C CB . VAL A 1 273 ? 45.493 74.696 21.379 1.00 32.36 ? 273 VAL A CB 1 ATOM 2196 C CG1 . VAL A 1 273 ? 46.118 75.566 22.465 1.00 32.48 ? 273 VAL A CG1 1 ATOM 2197 C CG2 . VAL A 1 273 ? 44.716 75.538 20.381 1.00 31.53 ? 273 VAL A CG2 1 ATOM 2198 N N . PRO A 1 274 ? 48.647 72.901 21.467 1.00 74.26 ? 274 PRO A N 1 ATOM 2199 C CA . PRO A 1 274 ? 49.460 72.087 22.372 1.00 75.29 ? 274 PRO A CA 1 ATOM 2200 C C . PRO A 1 274 ? 49.593 72.741 23.735 1.00 75.35 ? 274 PRO A C 1 ATOM 2201 O O . PRO A 1 274 ? 49.516 73.968 23.852 1.00 72.47 ? 274 PRO A O 1 ATOM 2202 C CB . PRO A 1 274 ? 50.794 72.003 21.642 1.00 75.75 ? 274 PRO A CB 1 ATOM 2203 C CG . PRO A 1 274 ? 50.875 73.349 20.983 1.00 74.36 ? 274 PRO A CG 1 ATOM 2204 C CD . PRO A 1 274 ? 49.482 73.509 20.414 1.00 71.51 ? 274 PRO A CD 1 ATOM 2205 N N . TRP A 1 275 ? 49.779 71.918 24.761 1.00 68.94 ? 275 TRP A N 1 ATOM 2206 C CA . TRP A 1 275 ? 49.949 72.425 26.113 1.00 76.08 ? 275 TRP A CA 1 ATOM 2207 C C . TRP A 1 275 ? 51.438 72.463 26.464 1.00 82.72 ? 275 TRP A C 1 ATOM 2208 O O . TRP A 1 275 ? 52.126 71.438 26.428 1.00 80.54 ? 275 TRP A O 1 ATOM 2209 C CB . TRP A 1 275 ? 49.204 71.551 27.125 1.00 81.87 ? 275 TRP A CB 1 ATOM 2210 C CG . TRP A 1 275 ? 49.408 72.027 28.522 1.00 74.13 ? 275 TRP A CG 1 ATOM 2211 C CD1 . TRP A 1 275 ? 49.018 73.230 29.047 1.00 75.04 ? 275 TRP A CD1 1 ATOM 2212 C CD2 . TRP A 1 275 ? 50.132 71.355 29.554 1.00 72.10 ? 275 TRP A CD2 1 ATOM 2213 N NE1 . TRP A 1 275 ? 49.463 73.351 30.342 1.00 79.14 ? 275 TRP A NE1 1 ATOM 2214 C CE2 . TRP A 1 275 ? 50.151 72.214 30.680 1.00 75.41 ? 275 TRP A CE2 1 ATOM 2215 C CE3 . TRP A 1 275 ? 50.771 70.110 29.639 1.00 74.49 ? 275 TRP A CE3 1 ATOM 2216 C CZ2 . TRP A 1 275 ? 50.787 71.867 31.881 1.00 77.47 ? 275 TRP A CZ2 1 ATOM 2217 C CZ3 . TRP A 1 275 ? 51.405 69.762 30.835 1.00 83.20 ? 275 TRP A CZ3 1 ATOM 2218 C CH2 . TRP A 1 275 ? 51.407 70.642 31.939 1.00 83.58 ? 275 TRP A CH2 1 ATOM 2219 N N . GLU A 1 276 ? 51.925 73.654 26.798 1.00 96.53 ? 276 GLU A N 1 ATOM 2220 C CA . GLU A 1 276 ? 53.326 73.842 27.152 1.00 104.47 ? 276 GLU A CA 1 ATOM 2221 C C . GLU A 1 276 ? 53.543 73.752 28.658 1.00 108.07 ? 276 GLU A C 1 ATOM 2222 O O . GLU A 1 276 ? 53.359 74.733 29.384 1.00 107.44 ? 276 GLU A O 1 ATOM 2223 C CB . GLU A 1 276 ? 53.819 75.197 26.637 1.00 122.46 ? 276 GLU A CB 1 ATOM 2224 C CG . GLU A 1 276 ? 53.763 75.335 25.123 1.00 130.19 ? 276 GLU A CG 1 ATOM 2225 C CD . GLU A 1 276 ? 54.587 74.278 24.412 1.00 134.76 ? 276 GLU A CD 1 ATOM 2226 O OE1 . GLU A 1 276 ? 55.823 74.261 24.598 1.00 138.19 ? 276 GLU A OE1 1 ATOM 2227 O OE2 . GLU A 1 276 ? 54.000 73.461 23.669 1.00 134.94 ? 276 GLU A OE2 1 ATOM 2228 N N . ALA A 1 277 ? 53.940 72.568 29.118 1.00 119.91 ? 277 ALA A N 1 ATOM 2229 C CA . ALA A 1 277 ? 54.184 72.331 30.536 1.00 122.87 ? 277 ALA A CA 1 ATOM 2230 C C . ALA A 1 277 ? 55.202 73.318 31.098 1.00 126.00 ? 277 ALA A C 1 ATOM 2231 O O . ALA A 1 277 ? 55.744 74.125 30.312 1.00 126.40 ? 277 ALA A O 1 ATOM 2232 C CB . ALA A 1 277 ? 54.669 70.899 30.746 1.00 97.83 ? 277 ALA A CB 1 HETATM 2233 C C1 . NAG B 2 . ? 10.581 82.891 -0.107 1.00 71.76 ? 310 NAG A C1 1 HETATM 2234 C C2 . NAG B 2 . ? 9.396 83.814 0.257 1.00 72.37 ? 310 NAG A C2 1 HETATM 2235 C C3 . NAG B 2 . ? 9.177 84.902 -0.817 1.00 76.10 ? 310 NAG A C3 1 HETATM 2236 C C4 . NAG B 2 . ? 10.494 85.593 -1.180 1.00 79.44 ? 310 NAG A C4 1 HETATM 2237 C C5 . NAG B 2 . ? 11.520 84.521 -1.563 1.00 81.38 ? 310 NAG A C5 1 HETATM 2238 C C6 . NAG B 2 . ? 12.877 85.041 -1.976 1.00 84.03 ? 310 NAG A C6 1 HETATM 2239 C C7 . NAG B 2 . ? 7.326 82.839 -0.585 1.00 83.22 ? 310 NAG A C7 1 HETATM 2240 C C8 . NAG B 2 . ? 7.700 81.820 -1.650 1.00 77.77 ? 310 NAG A C8 1 HETATM 2241 N N2 . NAG B 2 . ? 8.185 83.023 0.421 1.00 72.12 ? 310 NAG A N2 1 HETATM 2242 O O3 . NAG B 2 . ? 8.250 85.873 -0.349 1.00 72.19 ? 310 NAG A O3 1 HETATM 2243 O O4 . NAG B 2 . ? 10.282 86.490 -2.262 1.00 83.98 ? 310 NAG A O4 1 HETATM 2244 O O5 . NAG B 2 . ? 11.742 83.654 -0.443 1.00 78.17 ? 310 NAG A O5 1 HETATM 2245 O O6 . NAG B 2 . ? 13.849 84.004 -1.898 1.00 80.48 ? 310 NAG A O6 1 HETATM 2246 O O7 . NAG B 2 . ? 6.250 83.435 -0.667 1.00 88.10 ? 310 NAG A O7 1 HETATM 2247 C C1 . NAG C 2 . ? 28.982 85.672 26.316 1.00 31.04 ? 320 NAG A C1 1 HETATM 2248 C C2 . NAG C 2 . ? 30.438 86.185 26.280 1.00 39.04 ? 320 NAG A C2 1 HETATM 2249 C C3 . NAG C 2 . ? 31.357 85.362 27.179 1.00 42.08 ? 320 NAG A C3 1 HETATM 2250 C C4 . NAG C 2 . ? 30.760 85.278 28.581 1.00 40.80 ? 320 NAG A C4 1 HETATM 2251 C C5 . NAG C 2 . ? 29.369 84.654 28.463 1.00 38.87 ? 320 NAG A C5 1 HETATM 2252 C C6 . NAG C 2 . ? 28.685 84.462 29.792 1.00 42.40 ? 320 NAG A C6 1 HETATM 2253 C C7 . NAG C 2 . ? 30.921 87.296 24.195 1.00 38.16 ? 320 NAG A C7 1 HETATM 2254 C C8 . NAG C 2 . ? 31.503 87.233 22.788 1.00 36.02 ? 320 NAG A C8 1 HETATM 2255 N N2 . NAG C 2 . ? 30.946 86.175 24.921 1.00 34.77 ? 320 NAG A N2 1 HETATM 2256 O O3 . NAG C 2 . ? 32.635 85.978 27.234 1.00 43.31 ? 320 NAG A O3 1 HETATM 2257 O O4 . NAG C 2 . ? 31.604 84.480 29.431 1.00 46.53 ? 320 NAG A O4 1 HETATM 2258 O O5 . NAG C 2 . ? 28.522 85.512 27.672 1.00 36.04 ? 320 NAG A O5 1 HETATM 2259 O O6 . NAG C 2 . ? 28.354 85.711 30.374 1.00 39.22 ? 320 NAG A O6 1 HETATM 2260 O O7 . NAG C 2 . ? 30.450 88.367 24.615 1.00 34.72 ? 320 NAG A O7 1 HETATM 2261 C C1 . NAG D 2 . ? 32.111 85.116 30.551 1.00 64.93 ? 321 NAG A C1 1 HETATM 2262 C C2 . NAG D 2 . ? 32.468 84.070 31.607 1.00 71.10 ? 321 NAG A C2 1 HETATM 2263 C C3 . NAG D 2 . ? 33.182 84.722 32.802 1.00 81.24 ? 321 NAG A C3 1 HETATM 2264 C C4 . NAG D 2 . ? 34.367 85.568 32.326 1.00 85.13 ? 321 NAG A C4 1 HETATM 2265 C C5 . NAG D 2 . ? 33.897 86.555 31.250 1.00 86.56 ? 321 NAG A C5 1 HETATM 2266 C C6 . NAG D 2 . ? 35.034 87.375 30.667 1.00 85.49 ? 321 NAG A C6 1 HETATM 2267 C C7 . NAG D 2 . ? 31.208 82.076 32.059 1.00 77.88 ? 321 NAG A C7 1 HETATM 2268 C C8 . NAG D 2 . ? 31.288 81.387 33.410 1.00 83.99 ? 321 NAG A C8 1 HETATM 2269 N N2 . NAG D 2 . ? 31.262 83.402 32.052 1.00 69.21 ? 321 NAG A N2 1 HETATM 2270 O O3 . NAG D 2 . ? 33.652 83.712 33.681 1.00 76.93 ? 321 NAG A O3 1 HETATM 2271 O O4 . NAG D 2 . ? 34.932 86.275 33.424 1.00 93.70 ? 321 NAG A O4 1 HETATM 2272 O O5 . NAG D 2 . ? 33.283 85.838 30.154 1.00 78.29 ? 321 NAG A O5 1 HETATM 2273 O O6 . NAG D 2 . ? 35.391 86.915 29.369 1.00 85.54 ? 321 NAG A O6 1 HETATM 2274 O O7 . NAG D 2 . ? 31.112 81.408 31.033 1.00 81.81 ? 321 NAG A O7 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 GLN 1 1 ? ? ? A . n A 1 2 GLU 2 2 ? ? ? A . n A 1 3 ASN 3 3 ? ? ? A . n A 1 4 GLN 4 4 ? ? ? A . n A 1 5 ASP 5 5 5 ASP ASP A . n A 1 6 GLY 6 6 6 GLY GLY A . n A 1 7 ARG 7 7 7 ARG ARG A . n A 1 8 TYR 8 8 8 TYR TYR A . n A 1 9 SER 9 9 9 SER SER A . n A 1 10 LEU 10 10 10 LEU LEU A . n A 1 11 THR 11 11 11 THR THR A . n A 1 12 TYR 12 12 12 TYR TYR A . n A 1 13 ILE 13 13 13 ILE ILE A . n A 1 14 TYR 14 14 14 TYR TYR A . n A 1 15 THR 15 15 15 THR THR A . n A 1 16 GLY 16 16 16 GLY GLY A . n A 1 17 LEU 17 17 17 LEU LEU A . n A 1 18 SER 18 18 18 SER SER A . n A 1 19 LYS 19 19 19 LYS LYS A . n A 1 20 HIS 20 20 20 HIS HIS A . n A 1 21 VAL 21 21 21 VAL VAL A . n A 1 22 GLU 22 22 22 GLU GLU A . n A 1 23 ASP 23 23 23 ASP ASP A . n A 1 24 VAL 24 24 24 VAL VAL A . n A 1 25 PRO 25 25 25 PRO PRO A . n A 1 26 ALA 26 26 26 ALA ALA A . n A 1 27 PHE 27 27 27 PHE PHE A . n A 1 28 GLN 28 28 28 GLN GLN A . n A 1 29 ALA 29 29 29 ALA ALA A . n A 1 30 LEU 30 30 30 LEU LEU A . n A 1 31 GLY 31 31 31 GLY GLY A . n A 1 32 SER 32 32 32 SER SER A . n A 1 33 LEU 33 33 33 LEU LEU A . n A 1 34 ASN 34 34 34 ASN ASN A . n A 1 35 ASP 35 35 35 ASP ASP A . n A 1 36 LEU 36 36 36 LEU LEU A . n A 1 37 GLN 37 37 37 GLN GLN A . n A 1 38 PHE 38 38 38 PHE PHE A . n A 1 39 PHE 39 39 39 PHE PHE A . n A 1 40 ARG 40 40 40 ARG ARG A . n A 1 41 TYR 41 41 41 TYR TYR A . n A 1 42 ASN 42 42 42 ASN ASN A . n A 1 43 SER 43 43 43 SER SER A . n A 1 44 LYS 44 44 44 LYS LYS A . n A 1 45 ASP 45 45 45 ASP ASP A . n A 1 46 ARG 46 46 46 ARG ARG A . n A 1 47 LYS 47 47 47 LYS LYS A . n A 1 48 SER 48 48 48 SER SER A . n A 1 49 GLN 49 49 49 GLN GLN A . n A 1 50 PRO 50 50 50 PRO PRO A . n A 1 51 MET 51 51 51 MET MET A . n A 1 52 GLY 52 52 52 GLY GLY A . n A 1 53 LEU 53 53 53 LEU LEU A . n A 1 54 TRP 54 54 54 TRP TRP A . n A 1 55 ARG 55 55 55 ARG ARG A . n A 1 56 GLN 56 56 56 GLN GLN A . n A 1 57 VAL 57 57 57 VAL VAL A . n A 1 58 GLU 58 58 58 GLU GLU A . n A 1 59 GLY 59 59 59 GLY GLY A . n A 1 60 MET 60 60 60 MET MET A . n A 1 61 GLU 61 61 61 GLU GLU A . n A 1 62 ASP 62 62 62 ASP ASP A . n A 1 63 TRP 63 63 63 TRP TRP A . n A 1 64 LYS 64 64 64 LYS LYS A . n A 1 65 GLN 65 65 65 GLN GLN A . n A 1 66 ASP 66 66 66 ASP ASP A . n A 1 67 SER 67 67 67 SER SER A . n A 1 68 GLN 68 68 68 GLN GLN A . n A 1 69 LEU 69 69 69 LEU LEU A . n A 1 70 GLN 70 70 70 GLN GLN A . n A 1 71 LYS 71 71 71 LYS LYS A . n A 1 72 ALA 72 72 72 ALA ALA A . n A 1 73 ARG 73 73 73 ARG ARG A . n A 1 74 GLU 74 74 74 GLU GLU A . n A 1 75 ASP 75 75 75 ASP ASP A . n A 1 76 ILE 76 76 76 ILE ILE A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 MET 78 78 78 MET MET A . n A 1 79 GLU 79 79 79 GLU GLU A . n A 1 80 THR 80 80 80 THR THR A . n A 1 81 LEU 81 81 81 LEU LEU A . n A 1 82 LYS 82 82 82 LYS LYS A . n A 1 83 ASP 83 83 83 ASP ASP A . n A 1 84 ILE 84 84 84 ILE ILE A . n A 1 85 VAL 85 85 85 VAL VAL A . n A 1 86 GLU 86 86 86 GLU GLU A . n A 1 87 TYR 87 87 87 TYR TYR A . n A 1 88 TYR 88 88 88 TYR TYR A . n A 1 89 LYS 89 89 89 LYS LYS A . n A 1 90 ASP 90 90 90 ASP ASP A . n A 1 91 SER 91 91 91 SER SER A . n A 1 92 THR 92 92 92 THR THR A . n A 1 93 GLY 93 93 93 GLY GLY A . n A 1 94 SER 94 94 94 SER SER A . n A 1 95 HIS 95 95 95 HIS HIS A . n A 1 96 VAL 96 96 96 VAL VAL A . n A 1 97 LEU 97 97 97 LEU LEU A . n A 1 98 GLN 98 98 98 GLN GLN A . n A 1 99 GLY 99 99 99 GLY GLY A . n A 1 100 ARG 100 100 100 ARG ARG A . n A 1 101 PHE 101 101 101 PHE PHE A . n A 1 102 GLY 102 102 102 GLY GLY A . n A 1 103 CYS 103 103 103 CYS CYS A . n A 1 104 GLU 104 104 104 GLU GLU A . n A 1 105 ILE 105 105 105 ILE ILE A . n A 1 106 GLU 106 106 106 GLU GLU A . n A 1 107 ASN 107 107 107 ASN ASN A . n A 1 108 ASN 108 108 108 ASN ASN A . n A 1 109 ARG 109 109 109 ARG ARG A . n A 1 110 SER 110 110 110 SER SER A . n A 1 111 SER 111 111 111 SER SER A . n A 1 112 GLY 112 112 112 GLY GLY A . n A 1 113 ALA 113 113 113 ALA ALA A . n A 1 114 PHE 114 114 114 PHE PHE A . n A 1 115 TRP 115 115 115 TRP TRP A . n A 1 116 LYS 116 116 116 LYS LYS A . n A 1 117 TYR 117 117 117 TYR TYR A . n A 1 118 TYR 118 118 118 TYR TYR A . n A 1 119 TYR 119 119 119 TYR TYR A . n A 1 120 ASP 120 120 120 ASP ASP A . n A 1 121 GLY 121 121 121 GLY GLY A . n A 1 122 LYS 122 122 122 LYS LYS A . n A 1 123 ASP 123 123 123 ASP ASP A . n A 1 124 TYR 124 124 124 TYR TYR A . n A 1 125 ILE 125 125 125 ILE ILE A . n A 1 126 GLU 126 126 126 GLU GLU A . n A 1 127 PHE 127 127 127 PHE PHE A . n A 1 128 ASN 128 128 128 ASN ASN A . n A 1 129 LYS 129 129 129 LYS LYS A . n A 1 130 GLU 130 130 130 GLU GLU A . n A 1 131 ILE 131 131 131 ILE ILE A . n A 1 132 PRO 132 132 132 PRO PRO A . n A 1 133 ALA 133 133 133 ALA ALA A . n A 1 134 TRP 134 134 134 TRP TRP A . n A 1 135 VAL 135 135 135 VAL VAL A . n A 1 136 PRO 136 136 136 PRO PRO A . n A 1 137 PHE 137 137 137 PHE PHE A . n A 1 138 ASP 138 138 138 ASP ASP A . n A 1 139 PRO 139 139 139 PRO PRO A . n A 1 140 ALA 140 140 140 ALA ALA A . n A 1 141 ALA 141 141 141 ALA ALA A . n A 1 142 GLN 142 142 142 GLN GLN A . n A 1 143 ILE 143 143 143 ILE ILE A . n A 1 144 THR 144 144 144 THR THR A . n A 1 145 LYS 145 145 145 LYS LYS A . n A 1 146 GLN 146 146 146 GLN GLN A . n A 1 147 LYS 147 147 147 LYS LYS A . n A 1 148 TRP 148 148 148 TRP TRP A . n A 1 149 GLU 149 149 149 GLU GLU A . n A 1 150 ALA 150 150 150 ALA ALA A . n A 1 151 GLU 151 151 151 GLU GLU A . n A 1 152 PRO 152 152 152 PRO PRO A . n A 1 153 VAL 153 153 153 VAL VAL A . n A 1 154 TYR 154 154 154 TYR TYR A . n A 1 155 VAL 155 155 155 VAL VAL A . n A 1 156 GLN 156 156 156 GLN GLN A . n A 1 157 ARG 157 157 157 ARG ARG A . n A 1 158 ALA 158 158 158 ALA ALA A . n A 1 159 LYS 159 159 159 LYS LYS A . n A 1 160 ALA 160 160 160 ALA ALA A . n A 1 161 TYR 161 161 161 TYR TYR A . n A 1 162 LEU 162 162 162 LEU LEU A . n A 1 163 GLU 163 163 163 GLU GLU A . n A 1 164 GLU 164 164 164 GLU GLU A . n A 1 165 GLU 165 165 165 GLU GLU A . n A 1 166 CYS 166 166 166 CYS CYS A . n A 1 167 PRO 167 167 167 PRO PRO A . n A 1 168 ALA 168 168 168 ALA ALA A . n A 1 169 THR 169 169 169 THR THR A . n A 1 170 LEU 170 170 170 LEU LEU A . n A 1 171 ARG 171 171 171 ARG ARG A . n A 1 172 LYS 172 172 172 LYS LYS A . n A 1 173 TYR 173 173 173 TYR TYR A . n A 1 174 LEU 174 174 174 LEU LEU A . n A 1 175 LYS 175 175 175 LYS LYS A . n A 1 176 TYR 176 176 176 TYR TYR A . n A 1 177 SER 177 177 177 SER SER A . n A 1 178 LYS 178 178 178 LYS LYS A . n A 1 179 ASN 179 179 179 ASN ASN A . n A 1 180 ILE 180 180 180 ILE ILE A . n A 1 181 LEU 181 181 181 LEU LEU A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 ARG 183 183 183 ARG ARG A . n A 1 184 GLN 184 184 184 GLN GLN A . n A 1 185 ASP 185 185 185 ASP ASP A . n A 1 186 PRO 186 186 186 PRO PRO A . n A 1 187 PRO 187 187 187 PRO PRO A . n A 1 188 SER 188 188 188 SER SER A . n A 1 189 VAL 189 189 189 VAL VAL A . n A 1 190 VAL 190 190 190 VAL VAL A . n A 1 191 VAL 191 191 191 VAL VAL A . n A 1 192 THR 192 192 192 THR THR A . n A 1 193 SER 193 193 193 SER SER A . n A 1 194 HIS 194 194 194 HIS HIS A . n A 1 195 GLN 195 195 195 GLN GLN A . n A 1 196 ALA 196 196 196 ALA ALA A . n A 1 197 PRO 197 197 197 PRO PRO A . n A 1 198 GLY 198 198 198 GLY GLY A . n A 1 199 GLU 199 199 199 GLU GLU A . n A 1 200 LYS 200 200 200 LYS LYS A . n A 1 201 LYS 201 201 201 LYS LYS A . n A 1 202 LYS 202 202 202 LYS LYS A . n A 1 203 LEU 203 203 203 LEU LEU A . n A 1 204 LYS 204 204 204 LYS LYS A . n A 1 205 CYS 205 205 205 CYS CYS A . n A 1 206 LEU 206 206 206 LEU LEU A . n A 1 207 ALA 207 207 207 ALA ALA A . n A 1 208 TYR 208 208 208 TYR TYR A . n A 1 209 ASP 209 209 209 ASP ASP A . n A 1 210 PHE 210 210 210 PHE PHE A . n A 1 211 TYR 211 211 211 TYR TYR A . n A 1 212 PRO 212 212 212 PRO PRO A . n A 1 213 GLY 213 213 213 GLY GLY A . n A 1 214 LYS 214 214 214 LYS LYS A . n A 1 215 ILE 215 215 215 ILE ILE A . n A 1 216 ASP 216 216 216 ASP ASP A . n A 1 217 VAL 217 217 217 VAL VAL A . n A 1 218 HIS 218 218 218 HIS HIS A . n A 1 219 TRP 219 219 219 TRP TRP A . n A 1 220 THR 220 220 220 THR THR A . n A 1 221 ARG 221 221 221 ARG ARG A . n A 1 222 ALA 222 222 222 ALA ALA A . n A 1 223 GLY 223 223 223 GLY GLY A . n A 1 224 GLU 224 224 224 GLU GLU A . n A 1 225 VAL 225 225 225 VAL VAL A . n A 1 226 GLN 226 226 226 GLN GLN A . n A 1 227 GLU 227 227 227 GLU GLU A . n A 1 228 PRO 228 228 228 PRO PRO A . n A 1 229 GLU 229 229 229 GLU GLU A . n A 1 230 LEU 230 230 230 LEU LEU A . n A 1 231 ARG 231 231 231 ARG ARG A . n A 1 232 GLY 232 232 232 GLY GLY A . n A 1 233 ASP 233 233 233 ASP ASP A . n A 1 234 VAL 234 234 234 VAL VAL A . n A 1 235 LEU 235 235 235 LEU LEU A . n A 1 236 HIS 236 236 236 HIS HIS A . n A 1 237 ASN 237 237 237 ASN ASN A . n A 1 238 GLY 238 238 238 GLY GLY A . n A 1 239 ASN 239 239 239 ASN ASN A . n A 1 240 GLY 240 240 240 GLY GLY A . n A 1 241 THR 241 241 241 THR THR A . n A 1 242 TYR 242 242 242 TYR TYR A . n A 1 243 GLN 243 243 243 GLN GLN A . n A 1 244 SER 244 244 244 SER SER A . n A 1 245 TRP 245 245 245 TRP TRP A . n A 1 246 VAL 246 246 246 VAL VAL A . n A 1 247 VAL 247 247 247 VAL VAL A . n A 1 248 VAL 248 248 248 VAL VAL A . n A 1 249 ALA 249 249 249 ALA ALA A . n A 1 250 VAL 250 250 250 VAL VAL A . n A 1 251 PRO 251 251 251 PRO PRO A . n A 1 252 PRO 252 252 252 PRO PRO A . n A 1 253 GLN 253 253 253 GLN GLN A . n A 1 254 ASP 254 254 254 ASP ASP A . n A 1 255 THR 255 255 255 THR THR A . n A 1 256 ALA 256 256 256 ALA ALA A . n A 1 257 PRO 257 257 257 PRO PRO A . n A 1 258 TYR 258 258 258 TYR TYR A . n A 1 259 SER 259 259 259 SER SER A . n A 1 260 CYS 260 260 260 CYS CYS A . n A 1 261 HIS 261 261 261 HIS HIS A . n A 1 262 VAL 262 262 262 VAL VAL A . n A 1 263 GLN 263 263 263 GLN GLN A . n A 1 264 HIS 264 264 264 HIS HIS A . n A 1 265 SER 265 265 265 SER SER A . n A 1 266 SER 266 266 266 SER SER A . n A 1 267 LEU 267 267 267 LEU LEU A . n A 1 268 ALA 268 268 268 ALA ALA A . n A 1 269 GLN 269 269 269 GLN GLN A . n A 1 270 PRO 270 270 270 PRO PRO A . n A 1 271 LEU 271 271 271 LEU LEU A . n A 1 272 VAL 272 272 272 VAL VAL A . n A 1 273 VAL 273 273 273 VAL VAL A . n A 1 274 PRO 274 274 274 PRO PRO A . n A 1 275 TRP 275 275 275 TRP TRP A . n A 1 276 GLU 276 276 276 GLU GLU A . n A 1 277 ALA 277 277 277 ALA ALA A . n A 1 278 SER 278 278 ? ? ? A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 310 310 NAG NAG A . C 2 NAG 1 320 320 NAG NAG A . D 2 NAG 2 321 321 NAG NAG A . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 108 A ASN 108 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 239 A ASN 239 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2004-12-21 2 'Structure model' 1 1 2008-04-30 3 'Structure model' 1 2 2011-07-13 4 'Structure model' 1 3 2017-10-11 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Non-polymer description' 3 3 'Structure model' 'Version format compliance' 4 4 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 4 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # _phasing.method MR # loop_ _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id _software.pdbx_ordinal CNS 1.1 1998 package 'Axel T. Brunger' axel.brunger@yale.edu refinement http://cns.csb.yale.edu/v1.1/ Fortran_77 ? 1 DENZO . ? package 'Zbyszek Otwinowski' zbyszek@mix.swmed.edu 'data reduction' http://www.lnls.br/infra/linhasluz/denzo-hkl.htm ? ? 2 SCALEPACK . ? package 'Zbyszek Otwinowski' zbyszek@mix.swmed.edu 'data scaling' http://www.lnls.br/infra/linhasluz/denzo-hkl.htm ? ? 3 AMoRE . ? ? ? ? phasing ? ? ? 4 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 LYS A 19 ? ? -150.52 73.37 2 1 ASN A 34 ? ? 60.13 -127.94 3 1 ASN A 107 ? ? 70.83 45.75 4 1 ASN A 108 ? ? 59.65 2.46 5 1 GLU A 164 ? ? -126.85 -63.94 6 1 ASN A 179 ? ? -64.84 4.99 7 1 ILE A 180 ? ? -123.39 -54.75 8 1 GLN A 184 ? ? -142.22 51.93 9 1 PRO A 197 ? ? -49.49 103.73 10 1 ARG A 231 ? ? -176.76 135.66 11 1 PRO A 252 ? ? -56.04 -6.62 12 1 ALA A 256 ? ? -42.74 163.95 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A GLN 1 ? A GLN 1 2 1 Y 1 A GLU 2 ? A GLU 2 3 1 Y 1 A ASN 3 ? A ASN 3 4 1 Y 1 A GLN 4 ? A GLN 4 5 1 Y 1 A SER 278 ? A SER 278 # _pdbx_entity_nonpoly.entity_id 2 _pdbx_entity_nonpoly.name N-ACETYL-D-GLUCOSAMINE _pdbx_entity_nonpoly.comp_id NAG #